N-[(2-chloranyl-5-nitro-phenyl)methyl]-N-methyl-3-(phenylcarbamoylamino)propanamide

Systemtic Name: N-[(2-chloranyl-5-nitro-phenyl)methyl]-N-methyl-3-(phenylcarbamoylamino)propanamide Openeye Name: N-[(2-chloro-5-nitro-phenyl)methyl]-N-methyl-3-(phenylcarbamoylamino)propanamide CAS Name: 3-[[anilino(oxo)methyl]amino]-N-[(2-chloro-5-nitrophenyl)methyl]-N-methylpropanamide IUPAC Name: N-[(2-chloro-5-nitrophenyl)methyl]-N-methyl-3-(phenylcarbamoylamino)propanamide Traditional Name: N-(2-chloro-5-nitro-benzyl)-N-methyl-3-(phenylcarbamoylamino)propionamide Formula: C18H19ClN4O4 MolecularWeight: 390.82086

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C=CC(=C1)[N+](=O)[O-])Cl)C(=O)CCNC(=O)NC2=CC=CC=C2

Isomeric SMILES

CN(CC1=C(C=CC(=C1)[N+](=O)[O-])Cl)C(=O)CCNC(=O)NC2=CC=CC=C2

InChI

InChI=1S/C18H19ClN4O4/c1-22(12-13-11-15(23(26)27)7-8-16(13)19)17(24)9-10-20-18(25)21-14-5-3-2-4-6-14/h2-8,11H,9-10,12H2,1H3,(H2,20,21,25)