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

Systemtic Name: 3-[[5-methoxycarbonyl-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridin-3-yl]carbonylamino]-2-methyl-propanoic acid Openeye Name: 3-[[5-methoxycarbonyl-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carbonyl]amino]-2-methyl-propanoic acid CAS Name: 3-[[[5-methoxycarbonyl-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridin-3-yl]-oxomethyl]amino]-2-methylpropanoic acid IUPAC Name: 3-[[5-methoxycarbonyl-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carbonyl]amino]-2-methylpropanoic acid Traditional Name: 3-[[5-carbomethoxy-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carbonyl]amino]-2-methyl-propionic acid Formula: C19H21N3O7 MolecularWeight: 403.38594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=CN1)C(=O)NCC(C)C(=O)O)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=C(C(C(=CN1)C(=O)NCC(C)C(=O)O)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C19H21N3O7/c1-10(18(24)25)8-21-17(23)14-9-20-11(2)15(19(26)29-3)16(14)12-5-4-6-13(7-12)22(27)28/h4-7,9-10,16,20H,8H2,1-3H3,(H,21,23)(H,24,25)