3-[2-(2,5-dimethyl-1H-indol-3-yl)ethylamino]-5,5-dimethyl-2-pentanoyl-cyclohex-2-en-1-one

Systemtic Name: 3-[2-(2,5-dimethyl-1H-indol-3-yl)ethylamino]-5,5-dimethyl-2-pentanoyl-cyclohex-2-en-1-one Openeye Name: 3-[2-(2,5-dimethyl-1H-indol-3-yl)ethylamino]-5,5-dimethyl-2-pentanoyl-cyclohex-2-en-1-one CAS Name: 3-[2-(2,5-dimethyl-1H-indol-3-yl)ethylamino]-5,5-dimethyl-2-(1-oxopentyl)-1-cyclohex-2-enone IUPAC Name: 3-[2-(2,5-dimethyl-1H-indol-3-yl)ethylamino]-5,5-dimethyl-2-pentanoylcyclohex-2-en-1-one Traditional Name: 3-[2-(2,5-dimethyl-1H-indol-3-yl)ethylamino]-5,5-dimethyl-2-valeryl-cyclohex-2-en-1-one Formula: C25H34N2O2 MolecularWeight: 394.54966

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)C1=C(CC(CC1=O)(C)C)NCCC2=C(NC3=C2C=C(C=C3)C)C

Isomeric SMILES

CCCCC(=O)C1=C(CC(CC1=O)(C)C)NCCC2=C(NC3=C2C=C(C=C3)C)C

InChI

InChI=1S/C25H34N2O2/c1-6-7-8-22(28)24-21(14-25(4,5)15-23(24)29)26-12-11-18-17(3)27-20-10-9-16(2)13-19(18)20/h9-10,13,26-27H,6-8,11-12,14-15H2,1-5H3