(7-oxidanyl-6-pentoxy-3,4-dihydroisoquinolin-1-yl)-phenyl-methanone

Systemtic Name: (7-oxidanyl-6-pentoxy-3,4-dihydroisoquinolin-1-yl)-phenyl-methanone Openeye Name: (7-hydroxy-6-pentoxy-3,4-dihydroisoquinolin-1-yl)-phenyl-methanone CAS Name: (7-hydroxy-6-pentoxy-3,4-dihydroisoquinolin-1-yl)-phenylmethanone IUPAC Name: (7-hydroxy-6-pentoxy-3,4-dihydroisoquinolin-1-yl)-phenylmethanone Traditional Name: (6-amoxy-7-hydroxy-3,4-dihydroisoquinolin-1-yl)-phenyl-methanone Formula: C21H23NO3 MolecularWeight: 337.41222

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C2C(=C1)CCN=C2C(=O)C3=CC=CC=C3)O

Isomeric SMILES

CCCCCOC1=C(C=C2C(=C1)CCN=C2C(=O)C3=CC=CC=C3)O

InChI

InChI=1S/C21H23NO3/c1-2-3-7-12-25-19-13-16-10-11-22-20(17(16)14-18(19)23)21(24)15-8-5-4-6-9-15/h4-6,8-9,13-14,23H,2-3,7,10-12H2,1H3