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

Systemtic Name: (2R)-1-(2-azanylethanoyl)-4-(4-dimethylaminophenyl)carbonyl-N-[(3S)-2-oxidanylidenepiperidin-3-yl]piperazine-2-carboxamide Openeye Name: (2R)-1-(2-aminoacetyl)-4-[4-(dimethylamino)benzoyl]-N-[(3S)-2-oxo-3-piperidyl]piperazine-2-carboxamide CAS Name: (2R)-1-(2-amino-1-oxoethyl)-4-[(4-dimethylaminophenyl)-oxomethyl]-N-[(3S)-2-oxo-3-piperidinyl]-2-piperazinecarboxamide IUPAC Name: (2R)-1-(2-aminoacetyl)-4-[4-(dimethylamino)benzoyl]-N-[(3S)-2-oxopiperidin-3-yl]piperazine-2-carboxamide Traditional Name: (2R)-4-[4-(dimethylamino)benzoyl]-1-glycyl-N-[(3S)-2-keto-3-piperidyl]piperazine-2-carboxamide Formula: C21H30N6O4 MolecularWeight: 430.5007

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(=O)N2CCN(C(C2)C(=O)NC3CCCNC3=O)C(=O)CN

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C(=O)N2CCN([C@H](C2)C(=O)N[C@H]3CCCNC3=O)C(=O)CN

InChI

InChI=1S/C21H30N6O4/c1-25(2)15-7-5-14(6-8-15)21(31)26-10-11-27(18(28)12-22)17(13-26)20(30)24-16-4-3-9-23-19(16)29/h5-8,16-17H,3-4,9-13,22H2,1-2H3,(H,23,29)(H,24,30)/t16-,17+/m0/s1