ethyl 1-(1H-indol-5-ylcarbonyl)-3-phenethyl-piperidine-3-carboxylate

Systemtic Name: ethyl 1-(1H-indol-5-ylcarbonyl)-3-phenethyl-piperidine-3-carboxylate Openeye Name: ethyl 1-(1H-indole-5-carbonyl)-3-phenethyl-piperidine-3-carboxylate CAS Name: 1-[1H-indol-5-yl(oxo)methyl]-3-phenethyl-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(1H-indole-5-carbonyl)-3-phenethylpiperidine-3-carboxylate Traditional Name: 1-(1H-indole-5-carbonyl)-3-phenethyl-nipecotic acid ethyl ester Formula: C25H28N2O3 MolecularWeight: 404.50142

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCCN(C1)C(=O)C2=CC3=C(C=C2)NC=C3)CCC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1(CCCN(C1)C(=O)C2=CC3=C(C=C2)NC=C3)CCC4=CC=CC=C4

InChI

InChI=1S/C25H28N2O3/c1-2-30-24(29)25(14-11-19-7-4-3-5-8-19)13-6-16-27(18-25)23(28)21-9-10-22-20(17-21)12-15-26-22/h3-5,7-10,12,15,17,26H,2,6,11,13-14,16,18H2,1H3