3-methyl-1-[4-(1-pentylindol-3-yl)piperidin-1-yl]but-2-en-1-one

Systemtic Name: 3-methyl-1-[4-(1-pentylindol-3-yl)piperidin-1-yl]but-2-en-1-one Openeye Name: 3-methyl-1-[4-(1-pentylindol-3-yl)-1-piperidyl]but-2-en-1-one CAS Name: 3-methyl-1-[4-(1-pentyl-3-indolyl)-1-piperidinyl]-2-buten-1-one IUPAC Name: 3-methyl-1-[4-(1-pentylindol-3-yl)piperidin-1-yl]but-2-en-1-one Traditional Name: 1-[4-(1-amylindol-3-yl)piperidino]-3-methyl-but-2-en-1-one Formula: C23H32N2O MolecularWeight: 352.51298

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C=C(C2=CC=CC=C21)C3CCN(CC3)C(=O)C=C(C)C

Isomeric SMILES

CCCCCN1C=C(C2=CC=CC=C21)C3CCN(CC3)C(=O)C=C(C)C

InChI

InChI=1S/C23H32N2O/c1-4-5-8-13-25-17-21(20-9-6-7-10-22(20)25)19-11-14-24(15-12-19)23(26)16-18(2)3/h6-7,9-10,16-17,19H,4-5,8,11-15H2,1-3H3