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

Systemtic Name: [2-(dimethylaminomethyl)phenyl]methyl 4-nitrobenzoate Openeye Name: [2-(dimethylaminomethyl)phenyl]methyl 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [2-(dimethylaminomethyl)phenyl]methyl ester IUPAC Name: [2-(dimethylaminomethyl)phenyl]methyl 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [2-(dimethylaminomethyl)benzyl] ester Formula: C17H18N2O4 MolecularWeight: 314.33582

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N2O4/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