4-chloranyl-N-[(2S)-1-[[3-(hydroxymethyl)phenyl]amino]-3-methyl-1-oxidanylidene-butan-2-yl]-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N-[(2S)-1-[[3-(hydroxymethyl)phenyl]amino]-3-methyl-1-oxidanylidene-butan-2-yl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[(1S)-1-[[3-(hydroxymethyl)phenyl]carbamoyl]-2-methyl-propyl]-3-nitro-benzamide CAS Name: 4-chloro-N-[(2S)-1-[3-(hydroxymethyl)anilino]-3-methyl-1-oxobutan-2-yl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[(2S)-1-[3-(hydroxymethyl)anilino]-3-methyl-1-oxobutan-2-yl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[(1S)-2-methyl-1-[(3-methylolphenyl)carbamoyl]propyl]-3-nitro-benzamide Formula: C19H20ClN3O5 MolecularWeight: 405.8322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CC=CC(=C1)CO)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(C)[C@@H](C(=O)NC1=CC=CC(=C1)CO)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H20ClN3O5/c1-11(2)17(19(26)21-14-5-3-4-12(8-14)10-24)22-18(25)13-6-7-15(20)16(9-13)23(27)28/h3-9,11,17,24H,10H2,1-2H3,(H,21,26)(H,22,25)/t17-/m0/s1