[(3S)-2-[(3-methoxy-4-oxidanyl-phenyl)methyl]-3,4-dihydro-1H-isoquinolin-3-yl]-morpholin-4-yl-methanone

Systemtic Name: [(3S)-2-[(3-methoxy-4-oxidanyl-phenyl)methyl]-3,4-dihydro-1H-isoquinolin-3-yl]-morpholin-4-yl-methanone Openeye Name: [(3S)-2-[(4-hydroxy-3-methoxy-phenyl)methyl]-3,4-dihydro-1H-isoquinolin-3-yl]-morpholino-methanone CAS Name: [(3S)-2-[(4-hydroxy-3-methoxyphenyl)methyl]-3,4-dihydro-1H-isoquinolin-3-yl]-(4-morpholinyl)methanone IUPAC Name: [(3S)-2-[(4-hydroxy-3-methoxyphenyl)methyl]-3,4-dihydro-1H-isoquinolin-3-yl]-morpholin-4-ylmethanone Traditional Name: morpholino-[(3S)-2-vanillyl-3,4-dihydro-1H-isoquinolin-3-yl]methanone Formula: C22H26N2O4 MolecularWeight: 382.45284

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CN2CC3=CC=CC=C3CC2C(=O)N4CCOCC4)O

Isomeric SMILES

COC1=C(C=CC(=C1)CN2CC3=CC=CC=C3C[C@H]2C(=O)N4CCOCC4)O

InChI

InChI=1S/C22H26N2O4/c1-27-21-12-16(6-7-20(21)25)14-24-15-18-5-3-2-4-17(18)13-19(24)22(26)23-8-10-28-11-9-23/h2-7,12,19,25H,8-11,13-15H2,1H3/t19-/m0/s1