5-[4-[ethyl(2-hydroxyethyl)amino]-1-phenyl-butyl]-6-oxidanylidene-cyclohexa-1,3-diene-1-carbonitrile hydrochloride

Systemtic Name: 5-[4-[ethyl(2-hydroxyethyl)amino]-1-phenyl-butyl]-6-oxidanylidene-cyclohexa-1,3-diene-1-carbonitrile hydrochloride Openeye Name: 5-[4-[ethyl(2-hydroxyethyl)amino]-1-phenyl-butyl]-6-oxo-cyclohexa-1,3-diene-1-carbonitrile hydrochloride CAS Name: 5-[4-[ethyl(2-hydroxyethyl)amino]-1-phenylbutyl]-6-oxo-1-cyclohexa-1,3-dienecarbonitrile hydrochloride IUPAC Name: 5-[4-[ethyl(2-hydroxyethyl)amino]-1-phenylbutyl]-6-oxocyclohexa-1,3-diene-1-carbonitrile hydrochloride Traditional Name: 5-[4-[ethyl(2-hydroxyethyl)amino]-1-phenyl-butyl]-6-keto-cyclohexa-1,3-diene-1-carbonitrile hydrochloride Formula: C21H27ClN2O2 MolecularWeight: 374.90428

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCC(C1C=CC=C(C1=O)C#N)C2=CC=CC=C2)CCO.Cl

Isomeric SMILES

CCN(CCCC(C1C=CC=C(C1=O)C#N)C2=CC=CC=C2)CCO.Cl

InChI

InChI=1S/C21H26N2O2.ClH/c1-2-23(14-15-24)13-7-12-19(17-8-4-3-5-9-17)20-11-6-10-18(16-22)21(20)25;/h3-6,8-11,19-20,24H,2,7,12-15H2,1H3;1H