O3-(2-cyanoethyl) O5-(phenylmethyl) 4-(4-nitrophenyl)-2,6-dipropyl-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: O3-(2-cyanoethyl) O5-(phenylmethyl) 4-(4-nitrophenyl)-2,6-dipropyl-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O5-benzyl O3-(2-cyanoethyl) 4-(4-nitrophenyl)-2,6-dipropyl-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 4-(4-nitrophenyl)-2,6-dipropyl-1,4-dihydropyridine-3,5-dicarboxylic acid O3-(2-cyanoethyl) ester O5-(phenylmethyl) ester IUPAC Name: 5-O-benzyl 3-O-(2-cyanoethyl) 4-(4-nitrophenyl)-2,6-dipropyl-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 4-(4-nitrophenyl)-2,6-dipropyl-1,4-dihydropyridine-3,5-dicarboxylic acid O5-benzyl ester O3-(2-cyanoethyl) ester Formula: C29H31N3O6 MolecularWeight: 517.57294

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(C(=C(N1)CCC)C(=O)OCC2=CC=CC=C2)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)OCCC#N

Isomeric SMILES

CCCC1=C(C(C(=C(N1)CCC)C(=O)OCC2=CC=CC=C2)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)OCCC#N

InChI

InChI=1S/C29H31N3O6/c1-3-9-23-26(28(33)37-18-8-17-30)25(21-13-15-22(16-14-21)32(35)36)27(24(31-23)10-4-2)29(34)38-19-20-11-6-5-7-12-20/h5-7,11-16,25,31H,3-4,8-10,18-19H2,1-2H3