2-[[5-methoxycarbonyl-2-methyl-4-(3-nitrophenyl)-6-phenyl-1,4-dihydropyridin-3-yl]carbonylamino]ethanoic acid

Systemtic Name: 2-[[5-methoxycarbonyl-2-methyl-4-(3-nitrophenyl)-6-phenyl-1,4-dihydropyridin-3-yl]carbonylamino]ethanoic acid Openeye Name: 2-[[5-methoxycarbonyl-2-methyl-4-(3-nitrophenyl)-6-phenyl-1,4-dihydropyridine-3-carbonyl]amino]acetic acid CAS Name: 2-[[[5-methoxycarbonyl-2-methyl-4-(3-nitrophenyl)-6-phenyl-1,4-dihydropyridin-3-yl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[[5-methoxycarbonyl-2-methyl-4-(3-nitrophenyl)-6-phenyl-1,4-dihydropyridine-3-carbonyl]amino]acetic acid Traditional Name: 2-[[5-carbomethoxy-2-methyl-4-(3-nitrophenyl)-6-phenyl-1,4-dihydropyridine-3-carbonyl]amino]acetic acid Formula: C23H21N3O7 MolecularWeight: 451.42874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C2=CC=CC=C2)C(=O)OC)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)NCC(=O)O

Isomeric SMILES

CC1=C(C(C(=C(N1)C2=CC=CC=C2)C(=O)OC)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)NCC(=O)O

InChI

InChI=1S/C23H21N3O7/c1-13-18(22(29)24-12-17(27)28)19(15-9-6-10-16(11-15)26(31)32)20(23(30)33-2)21(25-13)14-7-4-3-5-8-14/h3-11,19,25H,12H2,1-2H3,(H,24,29)(H,27,28)