6-bromanyl-2-butyl-4-(4-methoxyphenyl)-5-(phenylmethyl)-2,3-dihydroinden-1-one

Systemtic Name: 6-bromanyl-2-butyl-4-(4-methoxyphenyl)-5-(phenylmethyl)-2,3-dihydroinden-1-one Openeye Name: 5-benzyl-6-bromo-2-butyl-4-(4-methoxyphenyl)indan-1-one CAS Name: 6-bromo-2-butyl-4-(4-methoxyphenyl)-5-(phenylmethyl)-2,3-dihydroinden-1-one IUPAC Name: 5-benzyl-6-bromo-2-butyl-4-(4-methoxyphenyl)-2,3-dihydroinden-1-one Traditional Name: 5-benzyl-6-bromo-2-butyl-4-(4-methoxyphenyl)indan-1-one Formula: C27H27BrO2 MolecularWeight: 463.40608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CC2=C(C(=C(C=C2C1=O)Br)CC3=CC=CC=C3)C4=CC=C(C=C4)OC

Isomeric SMILES

CCCCC1CC2=C(C(=C(C=C2C1=O)Br)CC3=CC=CC=C3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C27H27BrO2/c1-3-4-10-20-16-22-23(27(20)29)17-25(28)24(15-18-8-6-5-7-9-18)26(22)19-11-13-21(30-2)14-12-19/h5-9,11-14,17,20H,3-4,10,15-16H2,1-2H3