O3-ethyl O5-(3-phenylprop-2-ynyl) 2-(4-indol-1-ylphenyl)-6-methyl-4-phenethyl-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: O3-ethyl O5-(3-phenylprop-2-ynyl) 2-(4-indol-1-ylphenyl)-6-methyl-4-phenethyl-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O3-ethyl O5-(3-phenylprop-2-ynyl) 2-(4-indol-1-ylphenyl)-6-methyl-4-phenethyl-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2-[4-(1-indolyl)phenyl]-6-methyl-4-phenethyl-1,4-dihydropyridine-3,5-dicarboxylic acid O3-ethyl ester O5-(3-phenylprop-2-ynyl) ester IUPAC Name: 3-O-ethyl 5-O-(3-phenylprop-2-ynyl) 2-(4-indol-1-ylphenyl)-6-methyl-4-phenethyl-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2-(4-indol-1-ylphenyl)-6-methyl-4-phenethyl-1,4-dihydropyridine-3,5-dicarboxylic acid O3-ethyl ester O5-(3-phenylprop-2-ynyl) ester Formula: C41H36N2O4 MolecularWeight: 620.73554

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1CCC2=CC=CC=C2)C(=O)OCC#CC3=CC=CC=C3)C)C4=CC=C(C=C4)N5C=CC6=CC=CC=C65

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1CCC2=CC=CC=C2)C(=O)OCC#CC3=CC=CC=C3)C)C4=CC=C(C=C4)N5C=CC6=CC=CC=C65

InChI

InChI=1S/C41H36N2O4/c1-3-46-41(45)38-35(25-20-31-15-8-5-9-16-31)37(40(44)47-28-12-17-30-13-6-4-7-14-30)29(2)42-39(38)33-21-23-34(24-22-33)43-27-26-32-18-10-11-19-36(32)43/h4-11,13-16,18-19,21-24,26-27,35,42H,3,20,25,28H2,1-2H3