N-[3-[(4-bromanyl-3-methyl-phenyl)amino]-3-oxidanylidene-propyl]-4-nitro-benzamide

Systemtic Name: N-[3-[(4-bromanyl-3-methyl-phenyl)amino]-3-oxidanylidene-propyl]-4-nitro-benzamide Openeye Name: N-[3-(4-bromo-3-methyl-anilino)-3-oxo-propyl]-4-nitro-benzamide CAS Name: N-[3-(4-bromo-3-methylanilino)-3-oxopropyl]-4-nitrobenzamide IUPAC Name: N-[3-(4-bromo-3-methylanilino)-3-oxopropyl]-4-nitrobenzamide Traditional Name: N-[3-(4-bromo-3-methyl-anilino)-3-keto-propyl]-4-nitro-benzamide Formula: C17H16BrN3O4 MolecularWeight: 406.23064

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16BrN3O4/c1-11-10-13(4-7-15(11)18)20-16(22)8-9-19-17(23)12-2-5-14(6-3-12)21(24)25/h2-7,10H,8-9H2,1H3,(H,19,23)(H,20,22)