6-[4-(4-tert-butylphenyl)-1,3-dihydro-1,5-benzodiazepin-2-ylidene]-4-methyl-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[4-(4-tert-butylphenyl)-1,3-dihydro-1,5-benzodiazepin-2-ylidene]-4-methyl-cyclohexa-2,4-dien-1-one Openeye Name: 6-[4-(4-tert-butylphenyl)-1,3-dihydro-1,5-benzodiazepin-2-ylidene]-4-methyl-cyclohexa-2,4-dien-1-one CAS Name: 6-[4-(4-tert-butylphenyl)-1,3-dihydro-1,5-benzodiazepin-2-ylidene]-4-methyl-1-cyclohexa-2,4-dienone IUPAC Name: 6-[4-(4-tert-butylphenyl)-1,3-dihydro-1,5-benzodiazepin-2-ylidene]-4-methylcyclohexa-2,4-dien-1-one Traditional Name: 6-[4-(4-tert-butylphenyl)-1,3-dihydro-1,5-benzodiazepin-2-ylidene]-4-methyl-cyclohexa-2,4-dien-1-one Formula: C26H26N2O MolecularWeight: 382.49744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2CC(=NC3=CC=CC=C3N2)C4=CC=C(C=C4)C(C)(C)C)C(=O)C=C1

Isomeric SMILES

CC1=CC(=C2CC(=NC3=CC=CC=C3N2)C4=CC=C(C=C4)C(C)(C)C)C(=O)C=C1

InChI

InChI=1S/C26H26N2O/c1-17-9-14-25(29)20(15-17)24-16-23(27-21-7-5-6-8-22(21)28-24)18-10-12-19(13-11-18)26(2,3)4/h5-15,28H,16H2,1-4H3