O5-ethyl O3-methyl 2,6-dimethyl-4-[5-nitro-2-[4-(2-oxidanylpropylamino)butoxy]phenyl]-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: O5-ethyl O3-methyl 2,6-dimethyl-4-[5-nitro-2-[4-(2-oxidanylpropylamino)butoxy]phenyl]-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O5-ethyl O3-methyl 4-[2-[4-(2-hydroxypropylamino)butoxy]-5-nitro-phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 4-[2-[4-(2-hydroxypropylamino)butoxy]-5-nitrophenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid O5-ethyl ester O3-methyl ester IUPAC Name: 5-O-ethyl 3-O-methyl 4-[2-[4-(2-hydroxypropylamino)butoxy]-5-nitrophenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 4-[2-[4-(2-hydroxypropylamino)butoxy]-5-nitro-phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid O5-ethyl ester O3-methyl ester Formula: C25H35N3O8 MolecularWeight: 505.5607

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1C2=C(C=CC(=C2)[N+](=O)[O-])OCCCCNCC(C)O)C(=O)OC)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1C2=C(C=CC(=C2)[N+](=O)[O-])OCCCCNCC(C)O)C(=O)OC)C)C

InChI

InChI=1S/C25H35N3O8/c1-6-35-25(31)22-17(4)27-16(3)21(24(30)34-5)23(22)19-13-18(28(32)33)9-10-20(19)36-12-8-7-11-26-14-15(2)29/h9-10,13,15,23,26-27,29H,6-8,11-12,14H2,1-5H3