5-[3-[[1-(3,4-dimethoxyphenyl)-2-methyl-propan-2-yl]amino]-2-oxidanyl-propoxy]-8-prop-2-ynoxy-1H-quinolin-2-one

Systemtic Name: 5-[3-[[1-(3,4-dimethoxyphenyl)-2-methyl-propan-2-yl]amino]-2-oxidanyl-propoxy]-8-prop-2-ynoxy-1H-quinolin-2-one Openeye Name: 5-[3-[[2-(3,4-dimethoxyphenyl)-1,1-dimethyl-ethyl]amino]-2-hydroxy-propoxy]-8-prop-2-ynoxy-1H-quinolin-2-one CAS Name: 5-[3-[[1-(3,4-dimethoxyphenyl)-2-methylpropan-2-yl]amino]-2-hydroxypropoxy]-8-prop-2-ynoxy-1H-quinolin-2-one IUPAC Name: 5-[3-[[1-(3,4-dimethoxyphenyl)-2-methylpropan-2-yl]amino]-2-hydroxypropoxy]-8-prop-2-ynoxy-1H-quinolin-2-one Traditional Name: 5-[3-[[2-(3,4-dimethoxyphenyl)-1,1-dimethyl-ethyl]amino]-2-hydroxy-propoxy]-8-propargyloxy-carbostyril Formula: C27H32N2O6 MolecularWeight: 480.55278

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC1=CC(=C(C=C1)OC)OC)NCC(COC2=C3C=CC(=O)NC3=C(C=C2)OCC#C)O

Isomeric SMILES

CC(C)(CC1=CC(=C(C=C1)OC)OC)NCC(COC2=C3C=CC(=O)NC3=C(C=C2)OCC#C)O

InChI

InChI=1S/C27H32N2O6/c1-6-13-34-23-11-10-21(20-8-12-25(31)29-26(20)23)35-17-19(30)16-28-27(2,3)15-18-7-9-22(32-4)24(14-18)33-5/h1,7-12,14,19,28,30H,13,15-17H2,2-5H3,(H,29,31)