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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)C1=C(CC(CC1=O)C2=CC=CC=C2)NCCC3=C(NC4=CC=CC=C43)C

Isomeric SMILES

CCCCC(=O)C1=C(CC(CC1=O)C2=CC=CC=C2)NCCC3=C(NC4=CC=CC=C43)C

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/h5-13,21,29-30H,3-4,14-18H2,1-2H3