ethyl 4-[3-[1-[(2-methylphenyl)methyl]indol-3-yl]propanoylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[3-[1-[(2-methylphenyl)methyl]indol-3-yl]propanoylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[3-[1-(o-tolylmethyl)indol-3-yl]propanoylamino]piperidine-1-carboxylate CAS Name: 4-[[3-[1-[(2-methylphenyl)methyl]-3-indolyl]-1-oxopropyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-[1-[(2-methylphenyl)methyl]indol-3-yl]propanoylamino]piperidine-1-carboxylate Traditional Name: 4-[3-[1-(2-methylbenzyl)indol-3-yl]propanoylamino]piperidine-1-carboxylic acid ethyl ester Formula: C27H33N3O3 MolecularWeight: 447.56922

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)CCC2=CN(C3=CC=CC=C32)CC4=CC=CC=C4C

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)CCC2=CN(C3=CC=CC=C32)CC4=CC=CC=C4C

InChI

InChI=1S/C27H33N3O3/c1-3-33-27(32)29-16-14-23(15-17-29)28-26(31)13-12-22-19-30(25-11-7-6-10-24(22)25)18-21-9-5-4-8-20(21)2/h4-11,19,23H,3,12-18H2,1-2H3,(H,28,31)