2-[[3-[(2-chlorophenyl)methyl]-5-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]methylamino]-5-methyl-phenolate

Systemtic Name: 2-[[3-[(2-chlorophenyl)methyl]-5-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]methylamino]-5-methyl-phenolate Openeye Name: 2-[[3-[(2-chlorophenyl)methyl]-5-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene]methylamino]-5-methyl-phenolate CAS Name: 2-[[3-[(2-chlorophenyl)methyl]-5-nitro-6-oxo-1-cyclohexa-2,4-dienylidene]methylamino]-5-methylphenolate IUPAC Name: 2-[[3-[(2-chlorophenyl)methyl]-5-nitro-6-oxocyclohexa-2,4-dien-1-ylidene]methylamino]-5-methylphenolate Traditional Name: 2-[[3-(2-chlorobenzyl)-6-keto-5-nitro-cyclohexa-2,4-dien-1-ylidene]methylamino]-5-methyl-phenolate Formula: C21H16ClN2O4- MolecularWeight: 395.81574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC=C2C=C(C=C(C2=O)[N+](=O)[O-])CC3=CC=CC=C3Cl)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)NC=C2C=C(C=C(C2=O)[N+](=O)[O-])CC3=CC=CC=C3Cl)[O-]

InChI

InChI=1S/C21H17ClN2O4/c1-13-6-7-18(20(25)8-13)23-12-16-10-14(11-19(21(16)26)24(27)28)9-15-4-2-3-5-17(15)22/h2-8,10-12,23,25H,9H2,1H3/p-1