N-(2-bromanyl-4-methyl-phenyl)-3-[(2-nitrophenyl)amino]propanamide

Systemtic Name: N-(2-bromanyl-4-methyl-phenyl)-3-[(2-nitrophenyl)amino]propanamide Openeye Name: N-(2-bromo-4-methyl-phenyl)-3-(2-nitroanilino)propanamide CAS Name: N-(2-bromo-4-methylphenyl)-3-(2-nitroanilino)propanamide IUPAC Name: N-(2-bromo-4-methylphenyl)-3-(2-nitroanilino)propanamide Traditional Name: N-(2-bromo-4-methyl-phenyl)-3-(2-nitroanilino)propionamide Formula: C16H16BrN3O3 MolecularWeight: 378.22054

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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