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

Systemtic Name: 3-[[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-amino]-N-(3-nitrophenyl)propanamide Openeye Name: 3-[[2-(4-bromo-2-methyl-anilino)-2-oxo-ethyl]-methyl-amino]-N-(3-nitrophenyl)propanamide CAS Name: 3-[[2-(4-bromo-2-methylanilino)-2-oxoethyl]-methylamino]-N-(3-nitrophenyl)propanamide IUPAC Name: 3-[[2-(4-bromo-2-methylanilino)-2-oxoethyl]-methylamino]-N-(3-nitrophenyl)propanamide Traditional Name: 3-[[2-(4-bromo-2-methyl-anilino)-2-keto-ethyl]-methyl-amino]-N-(3-nitrophenyl)propionamide Formula: C19H21BrN4O4 MolecularWeight: 449.29844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CN(C)CCC(=O)NC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CN(C)CCC(=O)NC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C19H21BrN4O4/c1-13-10-14(20)6-7-17(13)22-19(26)12-23(2)9-8-18(25)21-15-4-3-5-16(11-15)24(27)28/h3-7,10-11H,8-9,12H2,1-2H3,(H,21,25)(H,22,26)