methyl 3-butanoyl-4-[6-[(2-butanoyl-4-methoxycarbonyl-5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl)amino]hexylamino]-6,6-dimethyl-2-oxidanylidene-cyclohex-3-ene-1-carboxylate

Systemtic Name: methyl 3-butanoyl-4-[6-[(2-butanoyl-4-methoxycarbonyl-5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl)amino]hexylamino]-6,6-dimethyl-2-oxidanylidene-cyclohex-3-ene-1-carboxylate Openeye Name: methyl 3-butanoyl-4-[6-[(2-butanoyl-4-methoxycarbonyl-5,5-dimethyl-3-oxo-cyclohexen-1-yl)amino]hexylamino]-6,6-dimethyl-2-oxo-cyclohex-3-ene-1-carboxylate CAS Name: 4-[6-[[4-methoxycarbonyl-5,5-dimethyl-3-oxo-2-(1-oxobutyl)-1-cyclohexenyl]amino]hexylamino]-6,6-dimethyl-2-oxo-3-(1-oxobutyl)-1-cyclohex-3-enecarboxylic acid methyl ester IUPAC Name: methyl 3-butanoyl-4-[6-[(2-butanoyl-4-methoxycarbonyl-5,5-dimethyl-3-oxocyclohexen-1-yl)amino]hexylamino]-6,6-dimethyl-2-oxocyclohex-3-ene-1-carboxylate Traditional Name: 3-butyryl-4-[6-[(2-butyryl-4-carbomethoxy-3-keto-5,5-dimethyl-cyclohexen-1-yl)amino]hexylamino]-2-keto-6,6-dimethyl-cyclohex-3-ene-1-carboxylic acid methyl ester Formula: C34H52N2O8 MolecularWeight: 616.78528

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=C(CC(C(C1=O)C(=O)OC)(C)C)NCCCCCCNC2=C(C(=O)C(C(C2)(C)C)C(=O)OC)C(=O)CCC

Isomeric SMILES

CCCC(=O)C1=C(CC(C(C1=O)C(=O)OC)(C)C)NCCCCCCNC2=C(C(=O)C(C(C2)(C)C)C(=O)OC)C(=O)CCC

InChI

InChI=1S/C34H52N2O8/c1-9-15-23(37)25-21(19-33(3,4)27(29(25)39)31(41)43-7)35-17-13-11-12-14-18-36-22-20-34(5,6)28(32(42)44-8)30(40)26(22)24(38)16-10-2/h27-28,35-36H,9-20H2,1-8H3