3-[(6-methoxy-4-propan-2-yloxy-quinolin-3-yl)methylperoxy]-3-oxidanylidene-2-(phenylmethyl)propanoate hydrochloride

Systemtic Name: 3-[(6-methoxy-4-propan-2-yloxy-quinolin-3-yl)methylperoxy]-3-oxidanylidene-2-(phenylmethyl)propanoate hydrochloride Openeye Name: 2-benzyl-3-[(4-isopropoxy-6-methoxy-3-quinolyl)methylperoxy]-3-oxo-propanoate hydrochloride CAS Name: 3-[(6-methoxy-4-propan-2-yloxy-3-quinolinyl)methyldioxy]-3-oxo-2-(phenylmethyl)propanoate hydrochloride IUPAC Name: 2-benzyl-3-[(6-methoxy-4-propan-2-yloxyquinolin-3-yl)methylperoxy]-3-oxopropanoate hydrochloride Traditional Name: 2-benzyl-3-[(4-isopropoxy-6-methoxy-3-quinolyl)methylperoxy]-3-keto-propionate hydrochloride Formula: C24H25ClNO7- MolecularWeight: 474.9108

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C2C=C(C=CC2=NC=C1COOC(=O)C(CC3=CC=CC=C3)C(=O)[O-])OC.Cl

Isomeric SMILES

CC(C)OC1=C2C=C(C=CC2=NC=C1COOC(=O)C(CC3=CC=CC=C3)C(=O)[O-])OC.Cl

InChI

InChI=1S/C24H25NO7.ClH/c1-15(2)31-22-17(13-25-21-10-9-18(29-3)12-19(21)22)14-30-32-24(28)20(23(26)27)11-16-7-5-4-6-8-16;/h4-10,12-13,15,20H,11,14H2,1-3H3,(H,26,27);1H/p-1