2-(dimethylaminomethyl)-1-(3-methoxyphenyl)-3,4-diphenyl-butan-1-one hydrochloride

Systemtic Name: 2-(dimethylaminomethyl)-1-(3-methoxyphenyl)-3,4-diphenyl-butan-1-one hydrochloride Openeye Name: 2-(dimethylaminomethyl)-1-(3-methoxyphenyl)-3,4-diphenyl-butan-1-one hydrochloride CAS Name: 2-(dimethylaminomethyl)-1-(3-methoxyphenyl)-3,4-diphenyl-1-butanone hydrochloride IUPAC Name: 2-(dimethylaminomethyl)-1-(3-methoxyphenyl)-3,4-diphenylbutan-1-one hydrochloride Traditional Name: 2-(dimethylaminomethyl)-1-(3-methoxyphenyl)-3,4-diphenyl-butan-1-one hydrochloride Formula: C26H30ClNO2 MolecularWeight: 423.9749

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC(C(CC1=CC=CC=C1)C2=CC=CC=C2)C(=O)C3=CC(=CC=C3)OC.Cl

Isomeric SMILES

CN(C)CC(C(CC1=CC=CC=C1)C2=CC=CC=C2)C(=O)C3=CC(=CC=C3)OC.Cl

InChI

InChI=1S/C26H29NO2.ClH/c1-27(2)19-25(26(28)22-15-10-16-23(18-22)29-3)24(21-13-8-5-9-14-21)17-20-11-6-4-7-12-20;/h4-16,18,24-25H,17,19H2,1-3H3;1H