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

Systemtic Name: 3-chloranyl-N-[(E)-[4-(ethylamino)-4-oxidanylidene-butan-2-ylidene]amino]-4-nitro-benzamide Openeye Name: 3-chloro-N-[(E)-[3-(ethylamino)-1-methyl-3-oxo-propylidene]amino]-4-nitro-benzamide CAS Name: 3-chloro-N-[(E)-[4-(ethylamino)-4-oxobutan-2-ylidene]amino]-4-nitrobenzamide IUPAC Name: 3-chloro-N-[(E)-[4-(ethylamino)-4-oxobutan-2-ylidene]amino]-4-nitrobenzamide Traditional Name: 3-chloro-N-[(E)-[3-(ethylamino)-3-keto-1-methyl-propylidene]amino]-4-nitro-benzamide Formula: C13H15ClN4O4 MolecularWeight: 326.7356

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15ClN4O4/c1-3-15-12(19)6-8(2)16-17-13(20)9-4-5-11(18(21)22)10(14)7-9/h4-5,7H,3,6H2,1-2H3,(H,15,19)(H,17,20)/b16-8+