(phenylmethyl) 4-[3-[3-(2-methoxy-2-oxidanylidene-ethyl)indol-1-yl]propyl]piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[3-[3-(2-methoxy-2-oxidanylidene-ethyl)indol-1-yl]propyl]piperidine-1-carboxylate Openeye Name: benzyl 4-[3-[3-(2-methoxy-2-oxo-ethyl)indol-1-yl]propyl]piperidine-1-carboxylate CAS Name: 4-[3-[3-(2-methoxy-2-oxoethyl)-1-indolyl]propyl]-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[3-[3-(2-methoxy-2-oxoethyl)indol-1-yl]propyl]piperidine-1-carboxylate Traditional Name: 4-[3-[3-(2-keto-2-methoxy-ethyl)indol-1-yl]propyl]piperidine-1-carboxylic acid benzyl ester Formula: C27H32N2O4 MolecularWeight: 448.55398

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CN(C2=CC=CC=C21)CCCC3CCN(CC3)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

COC(=O)CC1=CN(C2=CC=CC=C21)CCCC3CCN(CC3)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C27H32N2O4/c1-32-26(30)18-23-19-29(25-12-6-5-11-24(23)25)15-7-10-21-13-16-28(17-14-21)27(31)33-20-22-8-3-2-4-9-22/h2-6,8-9,11-12,19,21H,7,10,13-18,20H2,1H3