2-[(4-iodophenyl)-methoxy-methyl]-6-phenylmethoxy-3,4-dihydroisoquinolin-1-one

Systemtic Name: 2-[(4-iodophenyl)-methoxy-methyl]-6-phenylmethoxy-3,4-dihydroisoquinolin-1-one Openeye Name: 6-benzyloxy-2-[(4-iodophenyl)-methoxy-methyl]-3,4-dihydroisoquinolin-1-one CAS Name: 2-[(4-iodophenyl)-methoxymethyl]-6-phenylmethoxy-3,4-dihydroisoquinolin-1-one IUPAC Name: 2-[(4-iodophenyl)-methoxymethyl]-6-phenylmethoxy-3,4-dihydroisoquinolin-1-one Traditional Name: 6-benzoxy-2-[(4-iodophenyl)-methoxy-methyl]-3,4-dihydroisocarbostyril Formula: C24H22INO3 MolecularWeight: 499.34085

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Descriptors Computed from Structure

Canonical SMILES:

COC(C1=CC=C(C=C1)I)N2CCC3=C(C2=O)C=CC(=C3)OCC4=CC=CC=C4

Isomeric SMILES

COC(C1=CC=C(C=C1)I)N2CCC3=C(C2=O)C=CC(=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C24H22INO3/c1-28-24(18-7-9-20(25)10-8-18)26-14-13-19-15-21(11-12-22(19)23(26)27)29-16-17-5-3-2-4-6-17/h2-12,15,24H,13-14,16H2,1H3