methyl 3-[[4-[3-(2-methylpropanoylamino)phenyl]piperidin-1-yl]methyl]-1H-indole-6-carboxylate

Systemtic Name: methyl 3-[[4-[3-(2-methylpropanoylamino)phenyl]piperidin-1-yl]methyl]-1H-indole-6-carboxylate Openeye Name: methyl 3-[[4-[3-(2-methylpropanoylamino)phenyl]-1-piperidyl]methyl]-1H-indole-6-carboxylate CAS Name: 3-[[4-[3-[(2-methyl-1-oxopropyl)amino]phenyl]-1-piperidinyl]methyl]-1H-indole-6-carboxylic acid methyl ester IUPAC Name: methyl 3-[[4-[3-(2-methylpropanoylamino)phenyl]piperidin-1-yl]methyl]-1H-indole-6-carboxylate Traditional Name: 3-[[4-[3-(isobutyrylamino)phenyl]piperidino]methyl]-1H-indole-6-carboxylic acid methyl ester Formula: C26H31N3O3 MolecularWeight: 433.54264

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=CC(=C1)C2CCN(CC2)CC3=CNC4=C3C=CC(=C4)C(=O)OC

Isomeric SMILES

CC(C)C(=O)NC1=CC=CC(=C1)C2CCN(CC2)CC3=CNC4=C3C=CC(=C4)C(=O)OC

InChI

InChI=1S/C26H31N3O3/c1-17(2)25(30)28-22-6-4-5-19(13-22)18-9-11-29(12-10-18)16-21-15-27-24-14-20(26(31)32-3)7-8-23(21)24/h4-8,13-15,17-18,27H,9-12,16H2,1-3H3,(H,28,30)