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

Systemtic Name: 3-[2-(2-methyl-1H-indol-3-yl)ethylamino]-2-pentanoyl-5-phenyl-cyclohex-3-en-1-one Openeye Name: 3-[2-(2-methyl-1H-indol-3-yl)ethylamino]-2-pentanoyl-5-phenyl-cyclohex-3-en-1-one CAS Name: 3-[2-(2-methyl-1H-indol-3-yl)ethylamino]-2-(1-oxopentyl)-5-phenyl-1-cyclohex-3-enone IUPAC Name: 3-[2-(2-methyl-1H-indol-3-yl)ethylamino]-2-pentanoyl-5-phenylcyclohex-3-en-1-one Traditional Name: 3-[2-(2-methyl-1H-indol-3-yl)ethylamino]-5-phenyl-2-valeryl-cyclohex-3-en-1-one Formula: C28H32N2O2 MolecularWeight: 428.56588

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)C1C(=O)CC(C=C1NCCC2=C(NC3=CC=CC=C32)C)C4=CC=CC=C4

Isomeric SMILES

CCCCC(=O)C1C(=O)CC(C=C1NCCC2=C(NC3=CC=CC=C32)C)C4=CC=CC=C4

InChI

InChI=1S/C28H32N2O2/c1-3-4-14-26(31)28-25(17-21(18-27(28)32)20-10-6-5-7-11-20)29-16-15-22-19(2)30-24-13-9-8-12-23(22)24/h5-13,17,21,28-30H,3-4,14-16,18H2,1-2H3