prop-2-enyl 4-[3-(imidazol-1-ylmethyl)phenyl]-2,6-dimethyl-4-(3-nitrophenyl)-2-pyridin-3-yl-1,3-dihydropyridine-3-carboxylate

Systemtic Name: prop-2-enyl 4-[3-(imidazol-1-ylmethyl)phenyl]-2,6-dimethyl-4-(3-nitrophenyl)-2-pyridin-3-yl-1,3-dihydropyridine-3-carboxylate Openeye Name: allyl 4-[3-(imidazol-1-ylmethyl)phenyl]-2,6-dimethyl-4-(3-nitrophenyl)-2-(3-pyridyl)-1,3-dihydropyridine-3-carboxylate CAS Name: 4-[3-(1-imidazolylmethyl)phenyl]-2,6-dimethyl-4-(3-nitrophenyl)-2-(3-pyridinyl)-1,3-dihydropyridine-3-carboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 4-[3-(imidazol-1-ylmethyl)phenyl]-2,6-dimethyl-4-(3-nitrophenyl)-2-pyridin-3-yl-1,3-dihydropyridine-3-carboxylate Traditional Name: 4-[3-(imidazol-1-ylmethyl)phenyl]-2,6-dimethyl-4-(3-nitrophenyl)-2-(3-pyridyl)-1,3-dihydropyridine-3-carboxylic acid allyl ester Formula: C32H31N5O4 MolecularWeight: 549.61964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(C(C(N1)(C)C2=CN=CC=C2)C(=O)OCC=C)(C3=CC(=CC=C3)CN4C=CN=C4)C5=CC(=CC=C5)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(C(C(N1)(C)C2=CN=CC=C2)C(=O)OCC=C)(C3=CC(=CC=C3)CN4C=CN=C4)C5=CC(=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C32H31N5O4/c1-4-16-41-30(38)29-31(3,27-11-7-13-33-20-27)35-23(2)19-32(29,26-10-6-12-28(18-26)37(39)40)25-9-5-8-24(17-25)21-36-15-14-34-22-36/h4-15,17-20,22,29,35H,1,16,21H2,2-3H3