(E)-1-(5-methoxy-1-methyl-indol-3-yl)-3-(1-phenethylpiperidin-4-yl)prop-2-en-1-one hydrochloride

Systemtic Name: (E)-1-(5-methoxy-1-methyl-indol-3-yl)-3-(1-phenethylpiperidin-4-yl)prop-2-en-1-one hydrochloride Openeye Name: (E)-1-(5-methoxy-1-methyl-indol-3-yl)-3-(1-phenethyl-4-piperidyl)prop-2-en-1-one hydrochloride CAS Name: (E)-1-(5-methoxy-1-methyl-3-indolyl)-3-(1-phenethyl-4-piperidinyl)-2-propen-1-one hydrochloride IUPAC Name: (E)-1-(5-methoxy-1-methylindol-3-yl)-3-(1-phenethylpiperidin-4-yl)prop-2-en-1-one hydrochloride Traditional Name: (E)-1-(5-methoxy-1-methyl-indol-3-yl)-3-(1-phenethyl-4-piperidyl)prop-2-en-1-one hydrochloride Formula: C26H31ClN2O2 MolecularWeight: 438.98954

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=C1C=CC(=C2)OC)C(=O)C=CC3CCN(CC3)CCC4=CC=CC=C4.Cl

Isomeric SMILES

CN1C=C(C2=C1C=CC(=C2)OC)C(=O)/C=C/C3CCN(CC3)CCC4=CC=CC=C4.Cl

InChI

InChI=1S/C26H30N2O2.ClH/c1-27-19-24(23-18-22(30-2)9-10-25(23)27)26(29)11-8-21-13-16-28(17-14-21)15-12-20-6-4-3-5-7-20;/h3-11,18-19,21H,12-17H2,1-2H3;1H/b11-8+;