ethyl 1-[1-(phenylmethyl)-4-prop-2-enoxy-indol-2-yl]carbonylpiperidine-3-carboxylate

Systemtic Name: ethyl 1-[1-(phenylmethyl)-4-prop-2-enoxy-indol-2-yl]carbonylpiperidine-3-carboxylate Openeye Name: ethyl 1-(4-allyloxy-1-benzyl-indole-2-carbonyl)piperidine-3-carboxylate CAS Name: 1-[oxo-[1-(phenylmethyl)-4-prop-2-enoxy-2-indolyl]methyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(1-benzyl-4-prop-2-enoxyindole-2-carbonyl)piperidine-3-carboxylate Traditional Name: 1-(4-allyloxy-1-benzyl-indole-2-carbonyl)nipecotic acid ethyl ester Formula: C27H30N2O4 MolecularWeight: 446.5381

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2=CC3=C(N2CC4=CC=CC=C4)C=CC=C3OCC=C

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)C2=CC3=C(N2CC4=CC=CC=C4)C=CC=C3OCC=C

InChI

InChI=1S/C27H30N2O4/c1-3-16-33-25-14-8-13-23-22(25)17-24(29(23)18-20-10-6-5-7-11-20)26(30)28-15-9-12-21(19-28)27(31)32-4-2/h3,5-8,10-11,13-14,17,21H,1,4,9,12,15-16,18-19H2,2H3