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

Systemtic Name: 6-[[(2-butan-2-ylphenyl)amino]methylidene]-2-nitro-4-(phenylmethyl)cyclohexa-2,4-dien-1-one Openeye Name: 4-benzyl-2-nitro-6-[(2-sec-butylanilino)methylene]cyclohexa-2,4-dien-1-one CAS Name: 6-[(2-butan-2-ylanilino)methylidene]-2-nitro-4-(phenylmethyl)-1-cyclohexa-2,4-dienone IUPAC Name: 4-benzyl-6-[(2-butan-2-ylanilino)methylidene]-2-nitrocyclohexa-2,4-dien-1-one Traditional Name: 4-benzyl-2-nitro-6-[(2-sec-butylanilino)methylene]cyclohexa-2,4-dien-1-one Formula: C24H24N2O3 MolecularWeight: 388.45896

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC=C1NC=C2C=C(C=C(C2=O)[N+](=O)[O-])CC3=CC=CC=C3

Isomeric SMILES

CCC(C)C1=CC=CC=C1NC=C2C=C(C=C(C2=O)[N+](=O)[O-])CC3=CC=CC=C3

InChI

InChI=1S/C24H24N2O3/c1-3-17(2)21-11-7-8-12-22(21)25-16-20-14-19(13-18-9-5-4-6-10-18)15-23(24(20)27)26(28)29/h4-12,14-17,25H,3,13H2,1-2H3