1-methyl-5-[2-oxidanyl-3-[(phenylmethyl)amino]propoxy]-8-phenylmethoxy-3,4-dihydroquinolin-2-one hydrochloride

Systemtic Name: 1-methyl-5-[2-oxidanyl-3-[(phenylmethyl)amino]propoxy]-8-phenylmethoxy-3,4-dihydroquinolin-2-one hydrochloride Openeye Name: 5-[3-(benzylamino)-2-hydroxy-propoxy]-8-benzyloxy-1-methyl-3,4-dihydroquinolin-2-one hydrochloride CAS Name: 5-[2-hydroxy-3-[(phenylmethyl)amino]propoxy]-1-methyl-8-phenylmethoxy-3,4-dihydroquinolin-2-one hydrochloride IUPAC Name: 5-[3-(benzylamino)-2-hydroxypropoxy]-1-methyl-8-phenylmethoxy-3,4-dihydroquinolin-2-one hydrochloride Traditional Name: 8-benzoxy-5-[3-(benzylamino)-2-hydroxy-propoxy]-1-methyl-3,4-dihydrocarbostyril hydrochloride Formula: C27H31ClN2O4 MolecularWeight: 482.99904

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)CCC2=C(C=CC(=C21)OCC3=CC=CC=C3)OCC(CNCC4=CC=CC=C4)O.Cl

Isomeric SMILES

CN1C(=O)CCC2=C(C=CC(=C21)OCC3=CC=CC=C3)OCC(CNCC4=CC=CC=C4)O.Cl

InChI

InChI=1S/C27H30N2O4.ClH/c1-29-26(31)15-12-23-24(33-19-22(30)17-28-16-20-8-4-2-5-9-20)13-14-25(27(23)29)32-18-21-10-6-3-7-11-21;/h2-11,13-14,22,28,30H,12,15-19H2,1H3;1H