methyl 6-[[3-(4-methoxyoxan-2-yl)phenyl]methoxy]-1-phenyl-isoquinoline-3-carboxylate

Systemtic Name: methyl 6-[[3-(4-methoxyoxan-2-yl)phenyl]methoxy]-1-phenyl-isoquinoline-3-carboxylate Openeye Name: methyl 6-[[3-(4-methoxytetrahydropyran-2-yl)phenyl]methoxy]-1-phenyl-isoquinoline-3-carboxylate CAS Name: 6-[[3-(4-methoxy-2-oxanyl)phenyl]methoxy]-1-phenyl-3-isoquinolinecarboxylic acid methyl ester IUPAC Name: methyl 6-[[3-(4-methoxyoxan-2-yl)phenyl]methoxy]-1-phenylisoquinoline-3-carboxylate Traditional Name: 6-[3-(4-methoxytetrahydropyran-2-yl)benzyl]oxy-1-phenyl-isoquinoline-3-carboxylic acid methyl ester Formula: C30H29NO5 MolecularWeight: 483.55496

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Descriptors Computed from Structure

Canonical SMILES:

COC1CCOC(C1)C2=CC(=CC=C2)COC3=CC4=CC(=NC(=C4C=C3)C5=CC=CC=C5)C(=O)OC

Isomeric SMILES

COC1CCOC(C1)C2=CC(=CC=C2)COC3=CC4=CC(=NC(=C4C=C3)C5=CC=CC=C5)C(=O)OC

InChI

InChI=1S/C30H29NO5/c1-33-24-13-14-35-28(18-24)22-10-6-7-20(15-22)19-36-25-11-12-26-23(16-25)17-27(30(32)34-2)31-29(26)21-8-4-3-5-9-21/h3-12,15-17,24,28H,13-14,18-19H2,1-2H3