3-chloranyl-4-nitro-N-[(E)-[4-oxidanylidene-4-(1-phenylethylamino)butan-2-ylidene]amino]benzamide

Systemtic Name: 3-chloranyl-4-nitro-N-[(E)-[4-oxidanylidene-4-(1-phenylethylamino)butan-2-ylidene]amino]benzamide Openeye Name: 3-chloro-N-[(E)-[1-methyl-3-oxo-3-(1-phenylethylamino)propylidene]amino]-4-nitro-benzamide CAS Name: 3-chloro-4-nitro-N-[(E)-[4-oxo-4-(1-phenylethylamino)butan-2-ylidene]amino]benzamide IUPAC Name: 3-chloro-4-nitro-N-[(E)-[4-oxo-4-(1-phenylethylamino)butan-2-ylidene]amino]benzamide Traditional Name: 3-chloro-N-[(E)-[3-keto-1-methyl-3-(1-phenylethylamino)propylidene]amino]-4-nitro-benzamide Formula: C19H19ClN4O4 MolecularWeight: 402.83156

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19ClN4O4/c1-12(10-18(25)21-13(2)14-6-4-3-5-7-14)22-23-19(26)15-8-9-17(24(27)28)16(20)11-15/h3-9,11,13H,10H2,1-2H3,(H,21,25)(H,23,26)/b22-12+