N-[2-[(3,4-dimethoxyphenyl)methylamino]ethyl]-8-ethoxy-quinoline-5-sulfonamide

Systemtic Name: N-[2-[(3,4-dimethoxyphenyl)methylamino]ethyl]-8-ethoxy-quinoline-5-sulfonamide Openeye Name: N-[2-[(3,4-dimethoxyphenyl)methylamino]ethyl]-8-ethoxy-quinoline-5-sulfonamide CAS Name: N-[2-[(3,4-dimethoxyphenyl)methylamino]ethyl]-8-ethoxy-5-quinolinesulfonamide IUPAC Name: N-[2-[(3,4-dimethoxyphenyl)methylamino]ethyl]-8-ethoxyquinoline-5-sulfonamide Traditional Name: 8-ethoxy-N-[2-(veratrylamino)ethyl]quinoline-5-sulfonamide Formula: C22H27N3O5S MolecularWeight: 445.53188

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C2C(=C(C=C1)S(=O)(=O)NCCNCC3=CC(=C(C=C3)OC)OC)C=CC=N2

Isomeric SMILES

CCOC1=C2C(=C(C=C1)S(=O)(=O)NCCNCC3=CC(=C(C=C3)OC)OC)C=CC=N2

InChI

InChI=1S/C22H27N3O5S/c1-4-30-19-9-10-21(17-6-5-11-24-22(17)19)31(26,27)25-13-12-23-15-16-7-8-18(28-2)20(14-16)29-3/h5-11,14,23,25H,4,12-13,15H2,1-3H3