ethyl (3S)-1-[(2,5-dimethoxyphenyl)carbamoyl]-3-(phenylmethyl)piperidine-3-carboxylate

Systemtic Name: ethyl (3S)-1-[(2,5-dimethoxyphenyl)carbamoyl]-3-(phenylmethyl)piperidine-3-carboxylate Openeye Name: ethyl (3S)-3-benzyl-1-[(2,5-dimethoxyphenyl)carbamoyl]piperidine-3-carboxylate CAS Name: (3S)-1-[(2,5-dimethoxyanilino)-oxomethyl]-3-(phenylmethyl)-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3S)-3-benzyl-1-[(2,5-dimethoxyphenyl)carbamoyl]piperidine-3-carboxylate Traditional Name: (3S)-3-benzyl-1-[(2,5-dimethoxyphenyl)carbamoyl]nipecotic acid ethyl ester Formula: C24H30N2O5 MolecularWeight: 426.5054

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCCN(C1)C(=O)NC2=C(C=CC(=C2)OC)OC)CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)[C@@]1(CCCN(C1)C(=O)NC2=C(C=CC(=C2)OC)OC)CC3=CC=CC=C3

InChI

InChI=1S/C24H30N2O5/c1-4-31-22(27)24(16-18-9-6-5-7-10-18)13-8-14-26(17-24)23(28)25-20-15-19(29-2)11-12-21(20)30-3/h5-7,9-12,15H,4,8,13-14,16-17H2,1-3H3,(H,25,28)/t24-/m0/s1