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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC1=C(C(=O)CC(C1)C2=CC=CC=C2)C(=O)CCC3=NOC4=C3C(=O)CC(C4)(C)C

Isomeric SMILES

CCC(C)NC1=C(C(=O)CC(C1)C2=CC=CC=C2)C(=O)CCC3=NOC4=C3C(=O)CC(C4)(C)C

InChI

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