(6E)-6-[[(4-methoxyphenyl)amino]methylidene]-2-nitro-4-(phenylmethyl)cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-6-[[(4-methoxyphenyl)amino]methylidene]-2-nitro-4-(phenylmethyl)cyclohexa-2,4-dien-1-one Openeye Name: (6E)-4-benzyl-6-[(4-methoxyanilino)methylene]-2-nitro-cyclohexa-2,4-dien-1-one CAS Name: (6E)-6-[(4-methoxyanilino)methylidene]-2-nitro-4-(phenylmethyl)-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-4-benzyl-6-[(4-methoxyanilino)methylidene]-2-nitrocyclohexa-2,4-dien-1-one Traditional Name: (6E)-4-benzyl-2-nitro-6-(p-anisidinomethylene)cyclohexa-2,4-dien-1-one Formula: C21H18N2O4 MolecularWeight: 362.37862

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC=C2C=C(C=C(C2=O)[N+](=O)[O-])CC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)N/C=C/2\C=C(C=C(C2=O)[N+](=O)[O-])CC3=CC=CC=C3

InChI

InChI=1S/C21H18N2O4/c1-27-19-9-7-18(8-10-19)22-14-17-12-16(11-15-5-3-2-4-6-15)13-20(21(17)24)23(25)26/h2-10,12-14,22H,11H2,1H3/b17-14+