N-[(E)-[4-[(2-bromophenyl)amino]-4-oxidanylidene-butan-2-ylidene]amino]-3-chloranyl-4-nitro-benzamide

Systemtic Name: N-[(E)-[4-[(2-bromophenyl)amino]-4-oxidanylidene-butan-2-ylidene]amino]-3-chloranyl-4-nitro-benzamide Openeye Name: N-[(E)-[3-(2-bromoanilino)-1-methyl-3-oxo-propylidene]amino]-3-chloro-4-nitro-benzamide CAS Name: N-[(E)-[4-(2-bromoanilino)-4-oxobutan-2-ylidene]amino]-3-chloro-4-nitrobenzamide IUPAC Name: N-[(E)-[4-(2-bromoanilino)-4-oxobutan-2-ylidene]amino]-3-chloro-4-nitrobenzamide Traditional Name: N-[(E)-[3-(2-bromoanilino)-3-keto-1-methyl-propylidene]amino]-3-chloro-4-nitro-benzamide Formula: C17H14BrClN4O4 MolecularWeight: 453.67446

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC(=C(C=C1)[N+](=O)[O-])Cl)CC(=O)NC2=CC=CC=C2Br

Isomeric SMILES

C/C(=N\NC(=O)C1=CC(=C(C=C1)[N+](=O)[O-])Cl)/CC(=O)NC2=CC=CC=C2Br

InChI

InChI=1S/C17H14BrClN4O4/c1-10(8-16(24)20-14-5-3-2-4-12(14)18)21-22-17(25)11-6-7-15(23(26)27)13(19)9-11/h2-7,9H,8H2,1H3,(H,20,24)(H,22,25)/b21-10+