6,7-dimethoxy-3-(phenylsulfonyl)-4-pyrrolidin-1-yl-quinoline

Systemtic Name: 6,7-dimethoxy-3-(phenylsulfonyl)-4-pyrrolidin-1-yl-quinoline Openeye Name: 3-(benzenesulfonyl)-6,7-dimethoxy-4-pyrrolidin-1-yl-quinoline CAS Name: 3-(benzenesulfonyl)-6,7-dimethoxy-4-(1-pyrrolidinyl)quinoline IUPAC Name: 3-(benzenesulfonyl)-6,7-dimethoxy-4-pyrrolidin-1-ylquinoline Traditional Name: 3-besyl-6,7-dimethoxy-4-pyrrolidino-quinoline Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=C(C=N2)S(=O)(=O)C3=CC=CC=C3)N4CCCC4)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=C(C=N2)S(=O)(=O)C3=CC=CC=C3)N4CCCC4)OC

InChI

InChI=1S/C21H22N2O4S/c1-26-18-12-16-17(13-19(18)27-2)22-14-20(21(16)23-10-6-7-11-23)28(24,25)15-8-4-3-5-9-15/h3-5,8-9,12-14H,6-7,10-11H2,1-2H3