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

Systemtic Name: 5-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxidanyl-propoxy]-8-hex-2-ynoxy-1H-quinolin-2-one Openeye Name: 5-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-2-hydroxy-propoxy]-8-hex-2-ynoxy-1H-quinolin-2-one CAS Name: 5-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-2-hydroxypropoxy]-8-hex-2-ynoxy-1H-quinolin-2-one IUPAC Name: 5-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-2-hydroxypropoxy]-8-hex-2-ynoxy-1H-quinolin-2-one Traditional Name: 8-hex-2-ynoxy-5-[3-(homoveratrylamino)-2-hydroxy-propoxy]carbostyril Formula: C28H34N2O6 MolecularWeight: 494.57936

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Descriptors Computed from Structure

Canonical SMILES:

CCCC#CCOC1=C2C(=C(C=C1)OCC(CNCCC3=CC(=C(C=C3)OC)OC)O)C=CC(=O)N2

Isomeric SMILES

CCCC#CCOC1=C2C(=C(C=C1)OCC(CNCCC3=CC(=C(C=C3)OC)OC)O)C=CC(=O)N2

InChI

InChI=1S/C28H34N2O6/c1-4-5-6-7-16-35-25-12-11-23(22-9-13-27(32)30-28(22)25)36-19-21(31)18-29-15-14-20-8-10-24(33-2)26(17-20)34-3/h8-13,17,21,29,31H,4-5,14-16,18-19H2,1-3H3,(H,30,32)