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

Systemtic Name: methyl 3-butanoyl-4-[2-[(2-butanoyl-4-methoxycarbonyl-5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl)amino]propylamino]-6,6-dimethyl-2-oxidanylidene-cyclohex-3-ene-1-carboxylate Openeye Name: methyl 3-butanoyl-4-[2-[(2-butanoyl-4-methoxycarbonyl-5,5-dimethyl-3-oxo-cyclohexen-1-yl)amino]propylamino]-6,6-dimethyl-2-oxo-cyclohex-3-ene-1-carboxylate CAS Name: 4-[2-[[4-methoxycarbonyl-5,5-dimethyl-3-oxo-2-(1-oxobutyl)-1-cyclohexenyl]amino]propylamino]-6,6-dimethyl-2-oxo-3-(1-oxobutyl)-1-cyclohex-3-enecarboxylic acid methyl ester IUPAC Name: methyl 3-butanoyl-4-[2-[(2-butanoyl-4-methoxycarbonyl-5,5-dimethyl-3-oxocyclohexen-1-yl)amino]propylamino]-6,6-dimethyl-2-oxocyclohex-3-ene-1-carboxylate Traditional Name: 3-butyryl-4-[2-[(2-butyryl-4-carbomethoxy-3-keto-5,5-dimethyl-cyclohexen-1-yl)amino]propylamino]-2-keto-6,6-dimethyl-cyclohex-3-ene-1-carboxylic acid methyl ester Formula: C31H46N2O8 MolecularWeight: 574.70554

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=C(CC(C(C1=O)C(=O)OC)(C)C)NCC(C)NC2=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)NCC(C)NC2=C(C(=O)C(C(C2)(C)C)C(=O)OC)C(=O)CCC

InChI

InChI=1S/C31H46N2O8/c1-10-12-20(34)22-18(14-30(4,5)24(26(22)36)28(38)40-8)32-16-17(3)33-19-15-31(6,7)25(29(39)41-9)27(37)23(19)21(35)13-11-2/h17,24-25,32-33H,10-16H2,1-9H3