4-chloranyl-N-[(2S)-1-[[2-(dimethylaminomethyl)phenyl]methylamino]-1-oxidanylidene-propan-2-yl]-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N-[(2S)-1-[[2-(dimethylaminomethyl)phenyl]methylamino]-1-oxidanylidene-propan-2-yl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[(1S)-2-[[2-(dimethylaminomethyl)phenyl]methylamino]-1-methyl-2-oxo-ethyl]-3-nitro-benzamide CAS Name: 4-chloro-N-[(2S)-1-[[2-(dimethylaminomethyl)phenyl]methylamino]-1-oxopropan-2-yl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[(2S)-1-[[2-(dimethylaminomethyl)phenyl]methylamino]-1-oxopropan-2-yl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[(1S)-2-[[2-(dimethylaminomethyl)benzyl]amino]-2-keto-1-methyl-ethyl]-3-nitro-benzamide Formula: C20H23ClN4O4 MolecularWeight: 418.87402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CC=C1CN(C)C)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

C[C@@H](C(=O)NCC1=CC=CC=C1CN(C)C)NC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H23ClN4O4/c1-13(23-20(27)14-8-9-17(21)18(10-14)25(28)29)19(26)22-11-15-6-4-5-7-16(15)12-24(2)3/h4-10,13H,11-12H2,1-3H3,(H,22,26)(H,23,27)/t13-/m0/s1