N-[2-(3,4-dimethoxyphenyl)ethyl]-1-ethyl-6-morpholin-4-ylsulfonyl-4-oxidanylidene-quinoline-3-carboxamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-ethyl-6-morpholin-4-ylsulfonyl-4-oxidanylidene-quinoline-3-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-ethyl-6-morpholinosulfonyl-4-oxo-quinoline-3-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-ethyl-6-(4-morpholinylsulfonyl)-4-oxo-3-quinolinecarboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-ethyl-6-morpholin-4-ylsulfonyl-4-oxoquinoline-3-carboxamide Traditional Name: 1-ethyl-N-homoveratryl-4-keto-6-morpholinosulfonyl-quinoline-3-carboxamide Formula: C26H31N3O7S MolecularWeight: 529.60524

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=C1C=CC(=C2)S(=O)(=O)N3CCOCC3)C(=O)NCCC4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CCN1C=C(C(=O)C2=C1C=CC(=C2)S(=O)(=O)N3CCOCC3)C(=O)NCCC4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C26H31N3O7S/c1-4-28-17-21(26(31)27-10-9-18-5-8-23(34-2)24(15-18)35-3)25(30)20-16-19(6-7-22(20)28)37(32,33)29-11-13-36-14-12-29/h5-8,15-17H,4,9-14H2,1-3H3,(H,27,31)