6-[3-[(3,4-dimethoxycyclohexa-1,5-dien-1-yl)methylamino]-2-oxidanyl-propoxy]-1H-quinolin-2-one

Systemtic Name: 6-[3-[(3,4-dimethoxycyclohexa-1,5-dien-1-yl)methylamino]-2-oxidanyl-propoxy]-1H-quinolin-2-one Openeye Name: 6-[3-[(3,4-dimethoxycyclohexa-1,5-dien-1-yl)methylamino]-2-hydroxy-propoxy]-1H-quinolin-2-one CAS Name: 6-[3-[(3,4-dimethoxy-1-cyclohexa-1,5-dienyl)methylamino]-2-hydroxypropoxy]-1H-quinolin-2-one IUPAC Name: 6-[3-[(3,4-dimethoxycyclohexa-1,5-dien-1-yl)methylamino]-2-hydroxypropoxy]-1H-quinolin-2-one Traditional Name: 6-[3-[(3,4-dimethoxycyclohexa-1,5-dien-1-yl)methylamino]-2-hydroxy-propoxy]carbostyril Formula: C21H26N2O5 MolecularWeight: 386.44154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1C=CC(=CC1OC)CNCC(COC2=CC3=C(C=C2)NC(=O)C=C3)O

Isomeric SMILES

COC1C=CC(=CC1OC)CNCC(COC2=CC3=C(C=C2)NC(=O)C=C3)O

InChI

InChI=1S/C21H26N2O5/c1-26-19-7-3-14(9-20(19)27-2)11-22-12-16(24)13-28-17-5-6-18-15(10-17)4-8-21(25)23-18/h3-10,16,19-20,22,24H,11-13H2,1-2H3,(H,23,25)