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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CC(=NNC(=O)C2=CC=CC=C2[N+](=O)[O-])C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C/C(=N/NC(=O)C2=CC=CC=C2[N+](=O)[O-])/C)Cl

InChI

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