4-[(E)-4-phenyl-3-(1,4,4-trimethyl-2,3-dihydroquinolin-7-yl)but-1-enyl]benzoic acid

Systemtic Name: 4-[(E)-4-phenyl-3-(1,4,4-trimethyl-2,3-dihydroquinolin-7-yl)but-1-enyl]benzoic acid Openeye Name: 4-[(E)-4-phenyl-3-(1,4,4-trimethyl-2,3-dihydroquinolin-7-yl)but-1-enyl]benzoic acid CAS Name: 4-[(E)-4-phenyl-3-(1,4,4-trimethyl-2,3-dihydroquinolin-7-yl)but-1-enyl]benzoic acid IUPAC Name: 4-[(E)-4-phenyl-3-(1,4,4-trimethyl-2,3-dihydroquinolin-7-yl)but-1-enyl]benzoic acid Traditional Name: 4-[(E)-4-phenyl-3-(1,4,4-trimethyl-2,3-dihydroquinolin-7-yl)but-1-enyl]benzoic acid Formula: C29H31NO2 MolecularWeight: 425.56194

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCN(C2=C1C=CC(=C2)C(CC3=CC=CC=C3)C=CC4=CC=C(C=C4)C(=O)O)C)C

Isomeric SMILES

CC1(CCN(C2=C1C=CC(=C2)C(CC3=CC=CC=C3)/C=C/C4=CC=C(C=C4)C(=O)O)C)C

InChI

InChI=1S/C29H31NO2/c1-29(2)17-18-30(3)27-20-25(15-16-26(27)29)24(19-22-7-5-4-6-8-22)14-11-21-9-12-23(13-10-21)28(31)32/h4-16,20,24H,17-19H2,1-3H3,(H,31,32)/b14-11+