(phenylmethyl) 4-[2-[3-[(E)-3-ethoxy-2-methyl-3-oxidanylidene-prop-1-enyl]indol-1-yl]ethyl]piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[2-[3-[(E)-3-ethoxy-2-methyl-3-oxidanylidene-prop-1-enyl]indol-1-yl]ethyl]piperidine-1-carboxylate Openeye Name: benzyl 4-[2-[3-[(E)-3-ethoxy-2-methyl-3-oxo-prop-1-enyl]indol-1-yl]ethyl]piperidine-1-carboxylate CAS Name: 4-[2-[3-[(E)-3-ethoxy-2-methyl-3-oxoprop-1-enyl]-1-indolyl]ethyl]-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[2-[3-[(E)-3-ethoxy-2-methyl-3-oxoprop-1-enyl]indol-1-yl]ethyl]piperidine-1-carboxylate Traditional Name: 4-[2-[3-[(E)-3-ethoxy-3-keto-2-methyl-prop-1-enyl]indol-1-yl]ethyl]piperidine-1-carboxylic acid benzyl ester Formula: C29H34N2O4 MolecularWeight: 474.59126

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=CN(C2=CC=CC=C21)CCC3CCN(CC3)C(=O)OCC4=CC=CC=C4)C

Isomeric SMILES

CCOC(=O)/C(=C/C1=CN(C2=CC=CC=C21)CCC3CCN(CC3)C(=O)OCC4=CC=CC=C4)/C

InChI

InChI=1S/C29H34N2O4/c1-3-34-28(32)22(2)19-25-20-31(27-12-8-7-11-26(25)27)18-15-23-13-16-30(17-14-23)29(33)35-21-24-9-5-4-6-10-24/h4-12,19-20,23H,3,13-18,21H2,1-2H3/b22-19+