4-azanylidene-4-methoxy-2-[5-methoxycarbonyl-2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridin-3-yl]butanoic acid dihydrochloride

Systemtic Name: 4-azanylidene-4-methoxy-2-[5-methoxycarbonyl-2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridin-3-yl]butanoic acid dihydrochloride Openeye Name: 4-imino-4-methoxy-2-[5-methoxycarbonyl-2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridin-3-yl]butanoic acid dihydrochloride CAS Name: 4-imino-4-methoxy-2-[5-methoxycarbonyl-2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridin-3-yl]butanoic acid dihydrochloride IUPAC Name: 4-imino-4-methoxy-2-[5-methoxycarbonyl-2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridin-3-yl]butanoic acid dihydrochloride Traditional Name: 2-[5-carbomethoxy-2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridin-3-yl]-4-imino-4-methoxy-butyric acid dihydrochloride Formula: C20H25Cl2N3O7 MolecularWeight: 490.3344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)OC)C2=CC=CC=C2[N+](=O)[O-])C(CC(=N)OC)C(=O)O.Cl.Cl

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)OC)C2=CC=CC=C2[N+](=O)[O-])C(CC(=N)OC)C(=O)O.Cl.Cl

InChI

InChI=1S/C20H23N3O7.2ClH/c1-10-16(13(19(24)25)9-15(21)29-3)18(17(11(2)22-10)20(26)30-4)12-7-5-6-8-14(12)23(27)28;;/h5-8,13,18,21-22H,9H2,1-4H3,(H,24,25);2*1H