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(4-ethanoylphenyl) (3S)-1-(phenylcarbamoyl)piperidine-3-carboxylate

(4-ethanoylphenyl) (3S)-1-(phenylcarbamoyl)piperidine-3-carboxylate

Systemtic Name:(4-ethanoylphenyl) (3S)-1-(phenylcarbamoyl)piperidine-3-carboxylate
Openeye Name:(4-acetylphenyl) (3S)-1-(phenylcarbamoyl)piperidine-3-carboxylate
CAS Name:(3S)-1-[anilino(oxo)methyl]-3-piperidinecarboxylic acid (4-acetylphenyl) ester
IUPAC Name:(4-acetylphenyl) (3S)-1-(phenylcarbamoyl)piperidine-3-carboxylate
Traditional Name:(3S)-1-(phenylcarbamoyl)nipecotic acid (4-acetylphenyl) ester
Formula: C21H22N2O4
MolecularWeight: 366.41038
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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)OC(=O)C2CCCN(C2)C(=O)NC3=CC=CC=C3


Isomeric SMILES

CC(=O)C1=CC=C(C=C1)OC(=O)[C@H]2CCCN(C2)C(=O)NC3=CC=CC=C3


InChI

InChI=1S/C21H22N2O4/c1-15(24)16-9-11-19(12-10-16)27-20(25)17-6-5-13-23(14-17)21(26)22-18-7-3-2-4-8-18/h2-4,7-12,17H,5-6,13-14H2,1H3,(H,22,26)/t17-/m0/s1


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