[2-[(2S)-2-methylpiperidin-1-yl]-2-oxidanylidene-ethyl] 2-(2,5-dimethylphenyl)carbonylbenzoate

Systemtic Name: [2-[(2S)-2-methylpiperidin-1-yl]-2-oxidanylidene-ethyl] 2-(2,5-dimethylphenyl)carbonylbenzoate Openeye Name: [2-[(2S)-2-methyl-1-piperidyl]-2-oxo-ethyl] 2-(2,5-dimethylbenzoyl)benzoate CAS Name: 2-[(2,5-dimethylphenyl)-oxomethyl]benzoic acid [2-[(2S)-2-methyl-1-piperidinyl]-2-oxoethyl] ester IUPAC Name: [2-[(2S)-2-methylpiperidin-1-yl]-2-oxoethyl] 2-(2,5-dimethylbenzoyl)benzoate Traditional Name: 2-(2,5-dimethylbenzoyl)benzoic acid [2-keto-2-[(2S)-2-methylpiperidino]ethyl] ester Formula: C24H27NO4 MolecularWeight: 393.47548

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C(=O)COC(=O)C2=CC=CC=C2C(=O)C3=C(C=CC(=C3)C)C

Isomeric SMILES

C[C@H]1CCCCN1C(=O)COC(=O)C2=CC=CC=C2C(=O)C3=C(C=CC(=C3)C)C

InChI

InChI=1S/C24H27NO4/c1-16-11-12-17(2)21(14-16)23(27)19-9-4-5-10-20(19)24(28)29-15-22(26)25-13-7-6-8-18(25)3/h4-5,9-12,14,18H,6-8,13,15H2,1-3H3/t18-/m0/s1