(2S)-1-(2-azanylethanoyl)-N-[(3S)-2-oxidanylidenepiperidin-3-yl]-4-(phenylcarbonyl)piperazine-2-carboxamide

Systemtic Name: (2S)-1-(2-azanylethanoyl)-N-[(3S)-2-oxidanylidenepiperidin-3-yl]-4-(phenylcarbonyl)piperazine-2-carboxamide Openeye Name: (2S)-1-(2-aminoacetyl)-4-benzoyl-N-[(3S)-2-oxo-3-piperidyl]piperazine-2-carboxamide CAS Name: (2S)-1-(2-amino-1-oxoethyl)-4-benzoyl-N-[(3S)-2-oxo-3-piperidinyl]-2-piperazinecarboxamide IUPAC Name: (2S)-1-(2-aminoacetyl)-4-benzoyl-N-[(3S)-2-oxopiperidin-3-yl]piperazine-2-carboxamide Traditional Name: (2S)-4-benzoyl-1-glycyl-N-[(3S)-2-keto-3-piperidyl]piperazine-2-carboxamide Formula: C19H25N5O4 MolecularWeight: 387.4329

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(=O)NC1)NC(=O)C2CN(CCN2C(=O)CN)C(=O)C3=CC=CC=C3

Isomeric SMILES

C1C[C@@H](C(=O)NC1)NC(=O)[C@@H]2CN(CCN2C(=O)CN)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H25N5O4/c20-11-16(25)24-10-9-23(19(28)13-5-2-1-3-6-13)12-15(24)18(27)22-14-7-4-8-21-17(14)26/h1-3,5-6,14-15H,4,7-12,20H2,(H,21,26)(H,22,27)/t14-,15-/m0/s1