6-methoxy-3-methyl-1-methylsulfonyl-4-phenyl-isoquinoline

Systemtic Name: 6-methoxy-3-methyl-1-methylsulfonyl-4-phenyl-isoquinoline Openeye Name: 6-methoxy-3-methyl-1-methylsulfonyl-4-phenyl-isoquinoline CAS Name: 6-methoxy-3-methyl-1-methylsulfonyl-4-phenylisoquinoline IUPAC Name: 6-methoxy-3-methyl-1-methylsulfonyl-4-phenylisoquinoline Traditional Name: 1-mesyl-6-methoxy-3-methyl-4-phenyl-isoquinoline Formula: C18H17NO3S MolecularWeight: 327.39748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=CC(=C2)OC)C(=N1)S(=O)(=O)C)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C2=C(C=CC(=C2)OC)C(=N1)S(=O)(=O)C)C3=CC=CC=C3

InChI

InChI=1S/C18H17NO3S/c1-12-17(13-7-5-4-6-8-13)16-11-14(22-2)9-10-15(16)18(19-12)23(3,20)21/h4-11H,1-3H3