[4,4,7,8a-tetramethyl-8-(3-methylpent-4-enoyl)-1,2,3,6,7,8-hexahydronaphthalen-1-yl] ethanoate hydrate hydrochloride

Systemtic Name: [4,4,7,8a-tetramethyl-8-(3-methylpent-4-enoyl)-1,2,3,6,7,8-hexahydronaphthalen-1-yl] ethanoate hydrate hydrochloride Openeye Name: [4,4,7,8a-tetramethyl-8-(3-methylpent-4-enoyl)-1,2,3,6,7,8-hexahydronaphthalen-1-yl] acetate hydrate hydrochloride CAS Name: acetic acid [4,4,7,8a-tetramethyl-8-(3-methyl-1-oxopent-4-enyl)-1,2,3,6,7,8-hexahydronaphthalen-1-yl] ester hydrate hydrochloride IUPAC Name: [4,4,7,8a-tetramethyl-8-(3-methylpent-4-enoyl)-1,2,3,6,7,8-hexahydronaphthalen-1-yl] acetate hydrate hydrochloride Traditional Name: acetic acid [4,4,7,8a-tetramethyl-8-(3-methylpent-4-enoyl)-1,2,3,6,7,8-hexahydronaphthalen-1-yl] ester hydrate hydrochloride Formula: C22H37ClO4 MolecularWeight: 400.97978

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC=C2C(CCC(C2(C1C(=O)CC(C)C=C)C)OC(=O)C)(C)C.O.Cl

Isomeric SMILES

CC1CC=C2C(CCC(C2(C1C(=O)CC(C)C=C)C)OC(=O)C)(C)C.O.Cl

InChI

InChI=1S/C22H34O3.ClH.H2O/c1-8-14(2)13-17(24)20-15(3)9-10-18-21(5,6)12-11-19(22(18,20)7)25-16(4)23;;/h8,10,14-15,19-20H,1,9,11-13H2,2-7H3;1H;1H2