4-[(E)-1-[4-(2-dimethylaminoethyloxy)phenyl]-2-phenyl-but-1-enyl]phenol; ethanoic acid

Systemtic Name: 4-[(E)-1-[4-(2-dimethylaminoethyloxy)phenyl]-2-phenyl-but-1-enyl]phenol; ethanoic acid Openeye Name: acetic acid; 4-[(E)-1-[4-(2-dimethylaminoethyloxy)phenyl]-2-phenyl-but-1-enyl]phenol CAS Name: acetic acid; 4-[(E)-1-[4-(2-dimethylaminoethyloxy)phenyl]-2-phenylbut-1-enyl]phenol IUPAC Name: acetic acid; 4-[(E)-1-[4-(2-dimethylaminoethyloxy)phenyl]-2-phenylbut-1-enyl]phenol Traditional Name: acetic acid; 4-[(E)-1-[4-(2-dimethylaminoethyloxy)phenyl]-2-phenyl-but-1-enyl]phenol Formula: C28H33NO4 MolecularWeight: 447.56592

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C(C1=CC=C(C=C1)O)C2=CC=C(C=C2)OCCN(C)C)C3=CC=CC=C3.CC(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C26H29NO2.C2H4O2/c1-4-25(20-8-6-5-7-9-20)26(21-10-14-23(28)15-11-21)22-12-16-24(17-13-22)29-19-18-27(2)3;1-2(3)4/h5-17,28H,4,18-19H2,1-3H3;1H3,(H,3,4)/b26-25+;