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

Systemtic Name: 5-azanylidene-5-methoxy-2-[5-methoxycarbonyl-2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridin-3-yl]pentanoic acid Openeye Name: 5-imino-5-methoxy-2-[5-methoxycarbonyl-2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridin-3-yl]pentanoic acid CAS Name: 5-imino-5-methoxy-2-[5-methoxycarbonyl-2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridin-3-yl]pentanoic acid IUPAC Name: 5-imino-5-methoxy-2-[5-methoxycarbonyl-2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridin-3-yl]pentanoic acid Traditional Name: 2-[5-carbomethoxy-2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridin-3-yl]-5-imino-5-methoxy-valeric acid Formula: C21H25N3O7 MolecularWeight: 431.4391

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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(CCC(=N)OC)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C21H25N3O7/c1-11-17(14(20(25)26)9-10-16(22)30-3)19(18(12(2)23-11)21(27)31-4)13-7-5-6-8-15(13)24(28)29/h5-8,14,19,22-23H,9-10H2,1-4H3,(H,25,26)