7-[(3-chloranyl-2-cyclopentyl-phenyl)-phenylmethoxy-methoxy]-2-methyl-3,4-dihydro-1H-isoquinoline

Systemtic Name: 7-[(3-chloranyl-2-cyclopentyl-phenyl)-phenylmethoxy-methoxy]-2-methyl-3,4-dihydro-1H-isoquinoline Openeye Name: 7-[benzyloxy-(3-chloro-2-cyclopentyl-phenyl)methoxy]-2-methyl-3,4-dihydro-1H-isoquinoline CAS Name: 7-[(3-chloro-2-cyclopentylphenyl)-phenylmethoxymethoxy]-2-methyl-3,4-dihydro-1H-isoquinoline IUPAC Name: 7-[(3-chloro-2-cyclopentylphenyl)-phenylmethoxymethoxy]-2-methyl-3,4-dihydro-1H-isoquinoline Traditional Name: 7-[benzoxy-(3-chloro-2-cyclopentyl-phenyl)methoxy]-2-methyl-3,4-dihydro-1H-isoquinoline Formula: C29H32ClNO2 MolecularWeight: 462.02288

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=C(C1)C=C(C=C2)OC(C3=C(C(=CC=C3)Cl)C4CCCC4)OCC5=CC=CC=C5

Isomeric SMILES

CN1CCC2=C(C1)C=C(C=C2)OC(C3=C(C(=CC=C3)Cl)C4CCCC4)OCC5=CC=CC=C5

InChI

InChI=1S/C29H32ClNO2/c1-31-17-16-22-14-15-25(18-24(22)19-31)33-29(32-20-21-8-3-2-4-9-21)26-12-7-13-27(30)28(26)23-10-5-6-11-23/h2-4,7-9,12-15,18,23,29H,5-6,10-11,16-17,19-20H2,1H3