6-bromanyl-2-butyl-7-(4-methoxyphenyl)-5-(phenylmethyl)-2,3-dihydroinden-1-one

Systemtic Name: 6-bromanyl-2-butyl-7-(4-methoxyphenyl)-5-(phenylmethyl)-2,3-dihydroinden-1-one Openeye Name: 5-benzyl-6-bromo-2-butyl-7-(4-methoxyphenyl)indan-1-one CAS Name: 6-bromo-2-butyl-7-(4-methoxyphenyl)-5-(phenylmethyl)-2,3-dihydroinden-1-one IUPAC Name: 5-benzyl-6-bromo-2-butyl-7-(4-methoxyphenyl)-2,3-dihydroinden-1-one Traditional Name: 5-benzyl-6-bromo-2-butyl-7-(4-methoxyphenyl)indan-1-one Formula: C27H27BrO2 MolecularWeight: 463.40608

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CC2=CC(=C(C(=C2C1=O)C3=CC=C(C=C3)OC)Br)CC4=CC=CC=C4

Isomeric SMILES

CCCCC1CC2=CC(=C(C(=C2C1=O)C3=CC=C(C=C3)OC)Br)CC4=CC=CC=C4

InChI

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