3-[3-[2-(butylamino)-4,4-dimethyl-6-oxidanylidene-cyclohexen-1-yl]-3-oxidanylidene-propyl]-6-phenyl-6,7-dihydro-5H-1,2-benzoxazol-4-one

Systemtic Name: 3-[3-[2-(butylamino)-4,4-dimethyl-6-oxidanylidene-cyclohexen-1-yl]-3-oxidanylidene-propyl]-6-phenyl-6,7-dihydro-5H-1,2-benzoxazol-4-one Openeye Name: 3-[3-[2-(butylamino)-4,4-dimethyl-6-oxo-cyclohexen-1-yl]-3-oxo-propyl]-6-phenyl-6,7-dihydro-5H-1,2-benzoxazol-4-one CAS Name: 3-[3-[2-(butylamino)-4,4-dimethyl-6-oxo-1-cyclohexenyl]-3-oxopropyl]-6-phenyl-6,7-dihydro-5H-1,2-benzoxazol-4-one IUPAC Name: 3-[3-[2-(butylamino)-4,4-dimethyl-6-oxocyclohexen-1-yl]-3-oxopropyl]-6-phenyl-6,7-dihydro-5H-1,2-benzoxazol-4-one Traditional Name: 3-[3-[2-(butylamino)-6-keto-4,4-dimethyl-cyclohexen-1-yl]-3-keto-propyl]-6-phenyl-6,7-dihydro-5H-indoxazen-4-one Formula: C28H34N2O4 MolecularWeight: 462.58056

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C(C(=O)CC(C1)(C)C)C(=O)CCC2=NOC3=C2C(=O)CC(C3)C4=CC=CC=C4

Isomeric SMILES

CCCCNC1=C(C(=O)CC(C1)(C)C)C(=O)CCC2=NOC3=C2C(=O)CC(C3)C4=CC=CC=C4

InChI

InChI=1S/C28H34N2O4/c1-4-5-13-29-21-16-28(2,3)17-24(33)26(21)22(31)12-11-20-27-23(32)14-19(15-25(27)34-30-20)18-9-7-6-8-10-18/h6-10,19,29H,4-5,11-17H2,1-3H3