6-methoxy-1-[(3-oxidanyl-5-phenylmethoxy-phenyl)methyl]-3,4-dihydro-1H-isoquinoline-2-carbaldehyde

Systemtic Name: 6-methoxy-1-[(3-oxidanyl-5-phenylmethoxy-phenyl)methyl]-3,4-dihydro-1H-isoquinoline-2-carbaldehyde Openeye Name: 1-[(3-benzyloxy-5-hydroxy-phenyl)methyl]-6-methoxy-3,4-dihydro-1H-isoquinoline-2-carbaldehyde CAS Name: 1-[(3-hydroxy-5-phenylmethoxyphenyl)methyl]-6-methoxy-3,4-dihydro-1H-isoquinoline-2-carboxaldehyde IUPAC Name: 1-[(3-hydroxy-5-phenylmethoxyphenyl)methyl]-6-methoxy-3,4-dihydro-1H-isoquinoline-2-carbaldehyde Traditional Name: 1-(3-benzoxy-5-hydroxy-benzyl)-6-methoxy-3,4-dihydro-1H-isoquinoline-2-carbaldehyde Formula: C25H25NO4 MolecularWeight: 403.4703

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(N(CC2)C=O)CC3=CC(=CC(=C3)OCC4=CC=CC=C4)O

Isomeric SMILES

COC1=CC2=C(C=C1)C(N(CC2)C=O)CC3=CC(=CC(=C3)OCC4=CC=CC=C4)O

InChI

InChI=1S/C25H25NO4/c1-29-22-7-8-24-20(14-22)9-10-26(17-27)25(24)13-19-11-21(28)15-23(12-19)30-16-18-5-3-2-4-6-18/h2-8,11-12,14-15,17,25,28H,9-10,13,16H2,1H3