6-[[(2-butan-2-ylphenyl)amino]methylidene]-4-[(2-chlorophenyl)methyl]-2-nitro-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[[(2-butan-2-ylphenyl)amino]methylidene]-4-[(2-chlorophenyl)methyl]-2-nitro-cyclohexa-2,4-dien-1-one Openeye Name: 4-[(2-chlorophenyl)methyl]-2-nitro-6-[(2-sec-butylanilino)methylene]cyclohexa-2,4-dien-1-one CAS Name: 6-[(2-butan-2-ylanilino)methylidene]-4-[(2-chlorophenyl)methyl]-2-nitro-1-cyclohexa-2,4-dienone IUPAC Name: 6-[(2-butan-2-ylanilino)methylidene]-4-[(2-chlorophenyl)methyl]-2-nitrocyclohexa-2,4-dien-1-one Traditional Name: 4-(2-chlorobenzyl)-2-nitro-6-[(2-sec-butylanilino)methylene]cyclohexa-2,4-dien-1-one Formula: C24H23ClN2O3 MolecularWeight: 422.90402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC=C1NC=C2C=C(C=C(C2=O)[N+](=O)[O-])CC3=CC=CC=C3Cl

Isomeric SMILES

CCC(C)C1=CC=CC=C1NC=C2C=C(C=C(C2=O)[N+](=O)[O-])CC3=CC=CC=C3Cl

InChI

InChI=1S/C24H23ClN2O3/c1-3-16(2)20-9-5-7-11-22(20)26-15-19-13-17(14-23(24(19)28)27(29)30)12-18-8-4-6-10-21(18)25/h4-11,13-16,26H,3,12H2,1-2H3