3-[(E)-but-1-enyl]-5-(2-dimethylaminoethyloxy)-4-phenyl-2-(4-propan-2-ylphenyl)phenol hydrochloride

Systemtic Name: 3-[(E)-but-1-enyl]-5-(2-dimethylaminoethyloxy)-4-phenyl-2-(4-propan-2-ylphenyl)phenol hydrochloride Openeye Name: 3-[(E)-but-1-enyl]-5-(2-dimethylaminoethyloxy)-2-(4-isopropylphenyl)-4-phenyl-phenol hydrochloride CAS Name: 3-[(E)-but-1-enyl]-5-(2-dimethylaminoethyloxy)-4-phenyl-2-(4-propan-2-ylphenyl)phenol hydrochloride IUPAC Name: 3-[(E)-but-1-enyl]-5-(2-dimethylaminoethyloxy)-4-phenyl-2-(4-propan-2-ylphenyl)phenol hydrochloride Traditional Name: 3-[(E)-but-1-enyl]-5-(2-dimethylaminoethyloxy)-2-p-cumenyl-4-phenyl-phenol hydrochloride Formula: C29H36ClNO2 MolecularWeight: 466.05464

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Descriptors Computed from Structure

Canonical SMILES:

CCC=CC1=C(C(=CC(=C1C2=CC=CC=C2)OCCN(C)C)O)C3=CC=C(C=C3)C(C)C.Cl

Isomeric SMILES

CC/C=C/C1=C(C(=CC(=C1C2=CC=CC=C2)OCCN(C)C)O)C3=CC=C(C=C3)C(C)C.Cl

InChI

InChI=1S/C29H35NO2.ClH/c1-6-7-13-25-28(24-16-14-22(15-17-24)21(2)3)26(31)20-27(32-19-18-30(4)5)29(25)23-11-9-8-10-12-23;/h7-17,20-21,31H,6,18-19H2,1-5H3;1H/b13-7+;