6-cyclopentyloxy-7-methoxy-1-[(3-methoxyphenyl)methyl]-1H-isoquinoline-2-carboxylic acid

Systemtic Name: 6-cyclopentyloxy-7-methoxy-1-[(3-methoxyphenyl)methyl]-1H-isoquinoline-2-carboxylic acid Openeye Name: 6-(cyclopentoxy)-7-methoxy-1-[(3-methoxyphenyl)methyl]-1H-isoquinoline-2-carboxylic acid CAS Name: 6-cyclopentyloxy-7-methoxy-1-[(3-methoxyphenyl)methyl]-1H-isoquinoline-2-carboxylic acid IUPAC Name: 6-cyclopentyloxy-7-methoxy-1-[(3-methoxyphenyl)methyl]-1H-isoquinoline-2-carboxylic acid Traditional Name: 6-(cyclopentoxy)-1-m-anisyl-7-methoxy-1H-isoquinoline-2-carboxylic acid Formula: C24H27NO5 MolecularWeight: 409.47488

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CC2C3=CC(=C(C=C3C=CN2C(=O)O)OC4CCCC4)OC

Isomeric SMILES

COC1=CC=CC(=C1)CC2C3=CC(=C(C=C3C=CN2C(=O)O)OC4CCCC4)OC

InChI

InChI=1S/C24H27NO5/c1-28-19-9-5-6-16(12-19)13-21-20-15-22(29-2)23(30-18-7-3-4-8-18)14-17(20)10-11-25(21)24(26)27/h5-6,9-12,14-15,18,21H,3-4,7-8,13H2,1-2H3,(H,26,27)