4-chloranyl-N-[(2R)-3-methyl-1-oxidanylidene-1-(2-pyridin-2-ylethylamino)butan-2-yl]-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N-[(2R)-3-methyl-1-oxidanylidene-1-(2-pyridin-2-ylethylamino)butan-2-yl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[(1R)-2-methyl-1-[2-(2-pyridyl)ethylcarbamoyl]propyl]-3-nitro-benzamide CAS Name: 4-chloro-N-[(2R)-3-methyl-1-oxo-1-[2-(2-pyridinyl)ethylamino]butan-2-yl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[(2R)-3-methyl-1-oxo-1-(2-pyridin-2-ylethylamino)butan-2-yl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[(1R)-2-methyl-1-[2-(2-pyridyl)ethylcarbamoyl]propyl]-3-nitro-benzamide Formula: C19H21ClN4O4 MolecularWeight: 404.84744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCCC1=CC=CC=N1)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(C)[C@H](C(=O)NCCC1=CC=CC=N1)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H21ClN4O4/c1-12(2)17(19(26)22-10-8-14-5-3-4-9-21-14)23-18(25)13-6-7-15(20)16(11-13)24(27)28/h3-7,9,11-12,17H,8,10H2,1-2H3,(H,22,26)(H,23,25)/t17-/m1/s1