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

Systemtic Name: (phenylmethyl) 4-[2-[3-[(E)-3-ethoxy-3-oxidanylidene-prop-1-enyl]indol-1-yl]ethyl]piperidine-1-carboxylate Openeye Name: benzyl 4-[2-[3-[(E)-3-ethoxy-3-oxo-prop-1-enyl]indol-1-yl]ethyl]piperidine-1-carboxylate CAS Name: 4-[2-[3-[(E)-3-ethoxy-3-oxoprop-1-enyl]-1-indolyl]ethyl]-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[2-[3-[(E)-3-ethoxy-3-oxoprop-1-enyl]indol-1-yl]ethyl]piperidine-1-carboxylate Traditional Name: 4-[2-[3-[(E)-3-ethoxy-3-keto-prop-1-enyl]indol-1-yl]ethyl]piperidine-1-carboxylic acid benzyl ester Formula: C28H32N2O4 MolecularWeight: 460.56468

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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

Isomeric SMILES

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

InChI

InChI=1S/C28H32N2O4/c1-2-33-27(31)13-12-24-20-30(26-11-7-6-10-25(24)26)19-16-22-14-17-29(18-15-22)28(32)34-21-23-8-4-3-5-9-23/h3-13,20,22H,2,14-19,21H2,1H3/b13-12+