(phenylmethyl) 4-[3-methoxy-3-oxidanylidene-2-(phenylmethyl)propyl]sulfanylpiperidine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[3-methoxy-3-oxidanylidene-2-(phenylmethyl)propyl]sulfanylpiperidine-1-carboxylate Openeye Name: benzyl 4-(2-benzyl-3-methoxy-3-oxo-propyl)sulfanylpiperidine-1-carboxylate CAS Name: 4-[[3-methoxy-3-oxo-2-(phenylmethyl)propyl]thio]-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-(2-benzyl-3-methoxy-3-oxopropyl)sulfanylpiperidine-1-carboxylate Traditional Name: 4-[(2-benzyl-3-keto-3-methoxy-propyl)thio]piperidine-1-carboxylic acid benzyl ester Formula: C24H29NO4S MolecularWeight: 427.55636

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)CSC2CCN(CC2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

COC(=O)C(CC1=CC=CC=C1)CSC2CCN(CC2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C24H29NO4S/c1-28-23(26)21(16-19-8-4-2-5-9-19)18-30-22-12-14-25(15-13-22)24(27)29-17-20-10-6-3-7-11-20/h2-11,21-22H,12-18H2,1H3