(phenylmethyl) (2S)-3-cyclopropyl-2-[[(2R,6S)-2,6-dimethylpiperidin-1-yl]carbonylamino]propanoate

Systemtic Name: (phenylmethyl) (2S)-3-cyclopropyl-2-[[(2R,6S)-2,6-dimethylpiperidin-1-yl]carbonylamino]propanoate Openeye Name: benzyl (2S)-3-cyclopropyl-2-[[(2R,6S)-2,6-dimethylpiperidine-1-carbonyl]amino]propanoate CAS Name: (2S)-3-cyclopropyl-2-[[[(2R,6S)-2,6-dimethyl-1-piperidinyl]-oxomethyl]amino]propanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-3-cyclopropyl-2-[[(2R,6S)-2,6-dimethylpiperidine-1-carbonyl]amino]propanoate Traditional Name: (2S)-3-cyclopropyl-2-[[(2R,6S)-2,6-dimethylpiperidine-1-carbonyl]amino]propionic acid benzyl ester Formula: C21H30N2O3 MolecularWeight: 358.4745

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1C(=O)NC(CC2CC2)C(=O)OCC3=CC=CC=C3)C

Isomeric SMILES

C[C@@H]1CCC[C@@H](N1C(=O)N[C@@H](CC2CC2)C(=O)OCC3=CC=CC=C3)C

InChI

InChI=1S/C21H30N2O3/c1-15-7-6-8-16(2)23(15)21(25)22-19(13-17-11-12-17)20(24)26-14-18-9-4-3-5-10-18/h3-5,9-10,15-17,19H,6-8,11-14H2,1-2H3,(H,22,25)/t15-,16+,19-/m0/s1