(3S)-N-[2-[[(2S)-2-[4-(2-methylpropyl)phenyl]propanoyl]amino]ethyl]-2-oxidanylidene-piperidine-3-carboxamide

Systemtic Name: (3S)-N-[2-[[(2S)-2-[4-(2-methylpropyl)phenyl]propanoyl]amino]ethyl]-2-oxidanylidene-piperidine-3-carboxamide Openeye Name: (3S)-N-[2-[[(2S)-2-(4-isobutylphenyl)propanoyl]amino]ethyl]-2-oxo-piperidine-3-carboxamide CAS Name: (3S)-N-[2-[[(2S)-2-[4-(2-methylpropyl)phenyl]-1-oxopropyl]amino]ethyl]-2-oxo-3-piperidinecarboxamide IUPAC Name: (3S)-N-[2-[[(2S)-2-[4-(2-methylpropyl)phenyl]propanoyl]amino]ethyl]-2-oxopiperidine-3-carboxamide Traditional Name: (3S)-N-[2-[[(2S)-2-(4-isobutylphenyl)propanoyl]amino]ethyl]-2-keto-nipecotamide Formula: C21H31N3O3 MolecularWeight: 373.48914

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)C(C)C(=O)NCCNC(=O)C2CCCNC2=O

Isomeric SMILES

C[C@@H](C1=CC=C(C=C1)CC(C)C)C(=O)NCCNC(=O)[C@H]2CCCNC2=O

InChI

InChI=1S/C21H31N3O3/c1-14(2)13-16-6-8-17(9-7-16)15(3)19(25)23-11-12-24-21(27)18-5-4-10-22-20(18)26/h6-9,14-15,18H,4-5,10-13H2,1-3H3,(H,22,26)(H,23,25)(H,24,27)/t15-,18-/m0/s1