5-chloranyl-3-[2-[2-(ethoxymethyl)pyrrolidin-1-yl]ethyl]-2H-isoquinolin-1-one hydrochloride

Systemtic Name: 5-chloranyl-3-[2-[2-(ethoxymethyl)pyrrolidin-1-yl]ethyl]-2H-isoquinolin-1-one hydrochloride Openeye Name: 5-chloro-3-[2-[2-(ethoxymethyl)pyrrolidin-1-yl]ethyl]-2H-isoquinolin-1-one hydrochloride CAS Name: 5-chloro-3-[2-[2-(ethoxymethyl)-1-pyrrolidinyl]ethyl]-2H-isoquinolin-1-one hydrochloride IUPAC Name: 5-chloro-3-[2-[2-(ethoxymethyl)pyrrolidin-1-yl]ethyl]-2H-isoquinolin-1-one hydrochloride Traditional Name: 5-chloro-3-[2-[2-(ethoxymethyl)pyrrolidino]ethyl]isocarbostyril hydrochloride Formula: C18H24Cl2N2O2 MolecularWeight: 371.30136

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Descriptors Computed from Structure

Canonical SMILES:

CCOCC1CCCN1CCC2=CC3=C(C=CC=C3Cl)C(=O)N2.Cl

Isomeric SMILES

CCOCC1CCCN1CCC2=CC3=C(C=CC=C3Cl)C(=O)N2.Cl

InChI

InChI=1S/C18H23ClN2O2.ClH/c1-2-23-12-14-5-4-9-21(14)10-8-13-11-16-15(18(22)20-13)6-3-7-17(16)19;/h3,6-7,11,14H,2,4-5,8-10,12H2,1H3,(H,20,22);1H