5-[3-(cyclohexylamino)-2-oxidanyl-propoxy]-8-prop-2-ynoxy-1H-quinolin-2-one

Systemtic Name: 5-[3-(cyclohexylamino)-2-oxidanyl-propoxy]-8-prop-2-ynoxy-1H-quinolin-2-one Openeye Name: 5-[3-(cyclohexylamino)-2-hydroxy-propoxy]-8-prop-2-ynoxy-1H-quinolin-2-one CAS Name: 5-[3-(cyclohexylamino)-2-hydroxypropoxy]-8-prop-2-ynoxy-1H-quinolin-2-one IUPAC Name: 5-[3-(cyclohexylamino)-2-hydroxypropoxy]-8-prop-2-ynoxy-1H-quinolin-2-one Traditional Name: 5-[3-(cyclohexylamino)-2-hydroxy-propoxy]-8-propargyloxy-carbostyril Formula: C21H26N2O4 MolecularWeight: 370.44214

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOC1=C2C(=C(C=C1)OCC(CNC3CCCCC3)O)C=CC(=O)N2

Isomeric SMILES

C#CCOC1=C2C(=C(C=C1)OCC(CNC3CCCCC3)O)C=CC(=O)N2

InChI

InChI=1S/C21H26N2O4/c1-2-12-26-19-10-9-18(17-8-11-20(25)23-21(17)19)27-14-16(24)13-22-15-6-4-3-5-7-15/h1,8-11,15-16,22,24H,3-7,12-14H2,(H,23,25)