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

Systemtic Name: N-[(E)-[4-[(3-chloranyl-2-methyl-phenyl)amino]-4-oxidanylidene-butan-2-ylidene]amino]-3-nitro-benzamide Openeye Name: N-[(E)-[3-(3-chloro-2-methyl-anilino)-1-methyl-3-oxo-propylidene]amino]-3-nitro-benzamide CAS Name: N-[(E)-[4-(3-chloro-2-methylanilino)-4-oxobutan-2-ylidene]amino]-3-nitrobenzamide IUPAC Name: N-[(E)-[4-(3-chloro-2-methylanilino)-4-oxobutan-2-ylidene]amino]-3-nitrobenzamide Traditional Name: N-[(E)-[3-(3-chloro-2-methyl-anilino)-3-keto-1-methyl-propylidene]amino]-3-nitro-benzamide Formula: C18H17ClN4O4 MolecularWeight: 388.80498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)CC(=NNC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)C/C(=N/NC(=O)C2=CC(=CC=C2)[N+](=O)[O-])/C

InChI

InChI=1S/C18H17ClN4O4/c1-11(9-17(24)20-16-8-4-7-15(19)12(16)2)21-22-18(25)13-5-3-6-14(10-13)23(26)27/h3-8,10H,9H2,1-2H3,(H,20,24)(H,22,25)/b21-11+