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

Systemtic Name: N-[(E)-[4-[(4-chloranyl-3-nitro-phenyl)amino]-4-oxidanylidene-butan-2-ylidene]amino]-4-methoxy-benzamide Openeye Name: N-[(E)-[3-(4-chloro-3-nitro-anilino)-1-methyl-3-oxo-propylidene]amino]-4-methoxy-benzamide CAS Name: N-[(E)-[4-(4-chloro-3-nitroanilino)-4-oxobutan-2-ylidene]amino]-4-methoxybenzamide IUPAC Name: N-[(E)-[4-(4-chloro-3-nitroanilino)-4-oxobutan-2-ylidene]amino]-4-methoxybenzamide Traditional Name: N-[(E)-[3-(4-chloro-3-nitro-anilino)-3-keto-1-methyl-propylidene]amino]-4-methoxy-benzamide Formula: C18H17ClN4O5 MolecularWeight: 404.80438

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17ClN4O5/c1-11(21-22-18(25)12-3-6-14(28-2)7-4-12)9-17(24)20-13-5-8-15(19)16(10-13)23(26)27/h3-8,10H,9H2,1-2H3,(H,20,24)(H,22,25)/b21-11+