(7-cyanonaphthalen-2-yl)methyl 4-azanyl-4-oxidanylidene-butanoate dihydrochloride

Systemtic Name: (7-cyanonaphthalen-2-yl)methyl 4-azanyl-4-oxidanylidene-butanoate dihydrochloride Openeye Name: (7-cyano-2-naphthyl)methyl 4-amino-4-oxo-butanoate dihydrochloride CAS Name: 4-amino-4-oxobutanoic acid (7-cyano-2-naphthalenyl)methyl ester dihydrochloride IUPAC Name: (7-cyanonaphthalen-2-yl)methyl 4-amino-4-oxobutanoate dihydrochloride Traditional Name: 4-amino-4-keto-butyric acid (7-cyano-2-naphthyl)methyl ester dihydrochloride Formula: C16H16Cl2N2O3 MolecularWeight: 355.21584

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC2=C1C=CC(=C2)C#N)COC(=O)CCC(=O)N.Cl.Cl

Isomeric SMILES

C1=CC(=CC2=C1C=CC(=C2)C#N)COC(=O)CCC(=O)N.Cl.Cl

InChI

InChI=1S/C16H14N2O3.2ClH/c17-9-11-1-3-13-4-2-12(8-14(13)7-11)10-21-16(20)6-5-15(18)19;;/h1-4,7-8H,5-6,10H2,(H2,18,19);2*1H