3-[6-[(3-oxidanylidene-2-pentanoyl-5-phenyl-cyclohexen-1-yl)amino]hexylamino]-2-pentanoyl-5-phenyl-cyclohex-2-en-1-one

Systemtic Name: 3-[6-[(3-oxidanylidene-2-pentanoyl-5-phenyl-cyclohexen-1-yl)amino]hexylamino]-2-pentanoyl-5-phenyl-cyclohex-2-en-1-one Openeye Name: 3-[6-[(3-oxo-2-pentanoyl-5-phenyl-cyclohexen-1-yl)amino]hexylamino]-2-pentanoyl-5-phenyl-cyclohex-2-en-1-one CAS Name: 3-[6-[[3-oxo-2-(1-oxopentyl)-5-phenyl-1-cyclohexenyl]amino]hexylamino]-2-(1-oxopentyl)-5-phenyl-1-cyclohex-2-enone IUPAC Name: 3-[6-[(3-oxo-2-pentanoyl-5-phenylcyclohexen-1-yl)amino]hexylamino]-2-pentanoyl-5-phenylcyclohex-2-en-1-one Traditional Name: 3-[6-[(3-keto-5-phenyl-2-valeryl-cyclohexen-1-yl)amino]hexylamino]-5-phenyl-2-valeryl-cyclohex-2-en-1-one Formula: C40H52N2O4 MolecularWeight: 624.85188

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)C1=C(CC(CC1=O)C2=CC=CC=C2)NCCCCCCNC3=C(C(=O)CC(C3)C4=CC=CC=C4)C(=O)CCCC

Isomeric SMILES

CCCCC(=O)C1=C(CC(CC1=O)C2=CC=CC=C2)NCCCCCCNC3=C(C(=O)CC(C3)C4=CC=CC=C4)C(=O)CCCC

InChI

InChI=1S/C40H52N2O4/c1-3-5-21-35(43)39-33(25-31(27-37(39)45)29-17-11-9-12-18-29)41-23-15-7-8-16-24-42-34-26-32(30-19-13-10-14-20-30)28-38(46)40(34)36(44)22-6-4-2/h9-14,17-20,31-32,41-42H,3-8,15-16,21-28H2,1-2H3