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

Systemtic Name: 2-butanoyl-3-[2-(2-methyl-1H-indol-3-yl)ethylamino]-5-phenyl-cyclohex-2-en-1-one Openeye Name: 2-butanoyl-3-[2-(2-methyl-1H-indol-3-yl)ethylamino]-5-phenyl-cyclohex-2-en-1-one CAS Name: 3-[2-(2-methyl-1H-indol-3-yl)ethylamino]-2-(1-oxobutyl)-5-phenyl-1-cyclohex-2-enone IUPAC Name: 2-butanoyl-3-[2-(2-methyl-1H-indol-3-yl)ethylamino]-5-phenylcyclohex-2-en-1-one Traditional Name: 2-butyryl-3-[2-(2-methyl-1H-indol-3-yl)ethylamino]-5-phenyl-cyclohex-2-en-1-one Formula: C27H30N2O2 MolecularWeight: 414.5393

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H30N2O2/c1-3-9-25(30)27-24(16-20(17-26(27)31)19-10-5-4-6-11-19)28-15-14-21-18(2)29-23-13-8-7-12-22(21)23/h4-8,10-13,20,28-29H,3,9,14-17H2,1-2H3