3-[(4-bromophenyl)amino]-N-(2-methyl-5-nitro-phenyl)propanamide

Systemtic Name: 3-[(4-bromophenyl)amino]-N-(2-methyl-5-nitro-phenyl)propanamide Openeye Name: 3-(4-bromoanilino)-N-(2-methyl-5-nitro-phenyl)propanamide CAS Name: 3-(4-bromoanilino)-N-(2-methyl-5-nitrophenyl)propanamide IUPAC Name: 3-(4-bromoanilino)-N-(2-methyl-5-nitrophenyl)propanamide Traditional Name: 3-(4-bromoanilino)-N-(2-methyl-5-nitro-phenyl)propionamide Formula: C16H16BrN3O3 MolecularWeight: 378.22054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CCNC2=CC=C(C=C2)Br

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CCNC2=CC=C(C=C2)Br

InChI

InChI=1S/C16H16BrN3O3/c1-11-2-7-14(20(22)23)10-15(11)19-16(21)8-9-18-13-5-3-12(17)4-6-13/h2-7,10,18H,8-9H2,1H3,(H,19,21)