4-bromanyl-N-[(E)-[4-[(4-methoxy-2-nitro-phenyl)amino]-4-oxidanylidene-butan-2-ylidene]amino]benzamide

Systemtic Name: 4-bromanyl-N-[(E)-[4-[(4-methoxy-2-nitro-phenyl)amino]-4-oxidanylidene-butan-2-ylidene]amino]benzamide Openeye Name: 4-bromo-N-[(E)-[3-(4-methoxy-2-nitro-anilino)-1-methyl-3-oxo-propylidene]amino]benzamide CAS Name: 4-bromo-N-[(E)-[4-(4-methoxy-2-nitroanilino)-4-oxobutan-2-ylidene]amino]benzamide IUPAC Name: 4-bromo-N-[(E)-[4-(4-methoxy-2-nitroanilino)-4-oxobutan-2-ylidene]amino]benzamide Traditional Name: 4-bromo-N-[(E)-[3-keto-3-(4-methoxy-2-nitro-anilino)-1-methyl-propylidene]amino]benzamide Formula: C18H17BrN4O5 MolecularWeight: 449.25538

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC=C(C=C1)Br)CC(=O)NC2=C(C=C(C=C2)OC)[N+](=O)[O-]

Isomeric SMILES

C/C(=N\NC(=O)C1=CC=C(C=C1)Br)/CC(=O)NC2=C(C=C(C=C2)OC)[N+](=O)[O-]

InChI

InChI=1S/C18H17BrN4O5/c1-11(21-22-18(25)12-3-5-13(19)6-4-12)9-17(24)20-15-8-7-14(28-2)10-16(15)23(26)27/h3-8,10H,9H2,1-2H3,(H,20,24)(H,22,25)/b21-11+