Chem
J-GLOBAL ID:200907097816743935
Nikkaji number:J1.465.191H
(4R)-1,2,3,4-Tetrahydro-1,3,6-trimethyl-2-oxo-4α-(3-nitrophenyl)pyrimidine-5-carboxylic acid
(4R)-1,3,6-トリメチル-4-(3-ニトロフェニル)-2-オキソ-1,2,3,4-テトラヒドロピリミジン-5-カルボン酸
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Substance type:
Substance type
Substance type classified into 3 categories. Decided structure: Substances with a clear structure Undicided Structure: Substances with unknown or undetermined structure Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula:
C14 H15 N2 [N+]O4 [O-]
Molecular formula furigana:
C14-H15-N3-O5
Molecular weight:
305.290
InChI:
InChI=1S/C14H15N3O5/c1-8-11(13(18)19)12(16(3)14(20)15(8)2)9-5-4-6-10(7-9)17(21)22/h4-7,12H,1-3H3,(H,18,19)/t12-/m1/s1
InChI key:
IXKNBIRLRPYCMM-GFCCVEGCSA-N
SMILES:
CN1[C@@H](C(=C(C)N(C)C1=O)C(=O)O)c1cccc(c1)[N+](=O)[O-]
Systematic name (3):
(4R)-1,2,3,4-テトラヒドロ-1,3,6-トリメチル-2-オキソ-4α-(3-ニトロフェニル)ピリミジン-5-カルボン酸
(4R)-1,3,6-トリメチル-4-(3-ニトロフェニル)-2-オキソ-1,2,3,4-テトラヒドロピリミジン-5-カルボン酸
(4R)-1,3,6-trimethyl-4-(3-nitrophenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylic acid
Other name (1):
(4R)-1,2,3,4-Tetrahydro-1,3,6-trimethyl-2-oxo-4α-(3-nitrophenyl)pyrimidine-5-carboxylic acid
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