[2-(dimethylaminomethyl)phenyl]methyl 4-nitrobenzoate hydrochloride

Systemtic Name: [2-(dimethylaminomethyl)phenyl]methyl 4-nitrobenzoate hydrochloride Openeye Name: [2-(dimethylaminomethyl)phenyl]methyl 4-nitrobenzoate hydrochloride CAS Name: 4-nitrobenzoic acid [2-(dimethylaminomethyl)phenyl]methyl ester hydrochloride IUPAC Name: [2-(dimethylaminomethyl)phenyl]methyl 4-nitrobenzoate hydrochloride Traditional Name: 4-nitrobenzoic acid [2-(dimethylaminomethyl)benzyl] ester hydrochloride Formula: C17H19ClN2O4 MolecularWeight: 350.79676

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC=CC=C1COC(=O)C2=CC=C(C=C2)[N+](=O)[O-].Cl

Isomeric SMILES

CN(C)CC1=CC=CC=C1COC(=O)C2=CC=C(C=C2)[N+](=O)[O-].Cl

InChI

InChI=1S/C17H18N2O4.ClH/c1-18(2)11-14-5-3-4-6-15(14)12-23-17(20)13-7-9-16(10-8-13)19(21)22;/h3-10H,11-12H2,1-2H3;1H