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

Systemtic Name: 3-[2-(2,5-dimethyl-1H-indol-3-yl)ethylamino]-2-pentanoyl-5-phenyl-cyclohex-2-en-1-one Openeye Name: 3-[2-(2,5-dimethyl-1H-indol-3-yl)ethylamino]-2-pentanoyl-5-phenyl-cyclohex-2-en-1-one CAS Name: 3-[2-(2,5-dimethyl-1H-indol-3-yl)ethylamino]-2-(1-oxopentyl)-5-phenyl-1-cyclohex-2-enone IUPAC Name: 3-[2-(2,5-dimethyl-1H-indol-3-yl)ethylamino]-2-pentanoyl-5-phenylcyclohex-2-en-1-one Traditional Name: 3-[2-(2,5-dimethyl-1H-indol-3-yl)ethylamino]-5-phenyl-2-valeryl-cyclohex-2-en-1-one Formula: C29H34N2O2 MolecularWeight: 442.59246

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)C1=C(CC(CC1=O)C2=CC=CC=C2)NCCC3=C(NC4=C3C=C(C=C4)C)C

Isomeric SMILES

CCCCC(=O)C1=C(CC(CC1=O)C2=CC=CC=C2)NCCC3=C(NC4=C3C=C(C=C4)C)C

InChI

InChI=1S/C29H34N2O2/c1-4-5-11-27(32)29-26(17-22(18-28(29)33)21-9-7-6-8-10-21)30-15-14-23-20(3)31-25-13-12-19(2)16-24(23)25/h6-10,12-13,16,22,30-31H,4-5,11,14-15,17-18H2,1-3H3