5-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxidanyl-propoxy]-8-oxidanyl-3,4-dihydro-1H-quinolin-2-one

Systemtic Name: 5-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxidanyl-propoxy]-8-oxidanyl-3,4-dihydro-1H-quinolin-2-one Openeye Name: 5-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-2-hydroxy-propoxy]-8-hydroxy-3,4-dihydro-1H-quinolin-2-one CAS Name: 5-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-2-hydroxypropoxy]-8-hydroxy-3,4-dihydro-1H-quinolin-2-one IUPAC Name: 5-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-2-hydroxypropoxy]-8-hydroxy-3,4-dihydro-1H-quinolin-2-one Traditional Name: 5-[3-(homoveratrylamino)-2-hydroxy-propoxy]-8-hydroxy-3,4-dihydrocarbostyril Formula: C22H28N2O6 MolecularWeight: 416.46752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNCC(COC2=C3CCC(=O)NC3=C(C=C2)O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNCC(COC2=C3CCC(=O)NC3=C(C=C2)O)O)OC

InChI

InChI=1S/C22H28N2O6/c1-28-19-6-3-14(11-20(19)29-2)9-10-23-12-15(25)13-30-18-7-5-17(26)22-16(18)4-8-21(27)24-22/h3,5-7,11,15,23,25-26H,4,8-10,12-13H2,1-2H3,(H,24,27)