methyl 2-[2-[4-(dimethylamino)-4-phenyl-cyclohexylidene]ethanoylamino]-3-(1H-indol-3-yl)propanoate

Systemtic Name: methyl 2-[2-[4-(dimethylamino)-4-phenyl-cyclohexylidene]ethanoylamino]-3-(1H-indol-3-yl)propanoate Openeye Name: methyl 2-[[2-[4-(dimethylamino)-4-phenyl-cyclohexylidene]acetyl]amino]-3-(1H-indol-3-yl)propanoate CAS Name: 2-[[2-[4-(dimethylamino)-4-phenylcyclohexylidene]-1-oxoethyl]amino]-3-(1H-indol-3-yl)propanoic acid methyl ester IUPAC Name: methyl 2-[[2-[4-(dimethylamino)-4-phenylcyclohexylidene]acetyl]amino]-3-(1H-indol-3-yl)propanoate Traditional Name: 2-[[2-[4-(dimethylamino)-4-phenyl-cyclohexylidene]acetyl]amino]-3-(1H-indol-3-yl)propionic acid methyl ester Formula: C28H33N3O3 MolecularWeight: 459.57992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1(CCC(=CC(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)OC)CC1)C4=CC=CC=C4

Isomeric SMILES

CN(C)C1(CCC(=CC(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)OC)CC1)C4=CC=CC=C4

InChI

InChI=1S/C28H33N3O3/c1-31(2)28(22-9-5-4-6-10-22)15-13-20(14-16-28)17-26(32)30-25(27(33)34-3)18-21-19-29-24-12-8-7-11-23(21)24/h4-12,17,19,25,29H,13-16,18H2,1-3H3,(H,30,32)