2-(2-methylpropylamino)ethyl 3-nitrobenzoate hydrochloride

Systemtic Name: 2-(2-methylpropylamino)ethyl 3-nitrobenzoate hydrochloride Openeye Name: 2-(isobutylamino)ethyl 3-nitrobenzoate hydrochloride CAS Name: 3-nitrobenzoic acid 2-(2-methylpropylamino)ethyl ester hydrochloride IUPAC Name: 2-(2-methylpropylamino)ethyl 3-nitrobenzoate hydrochloride Traditional Name: 3-nitrobenzoic acid 2-(isobutylamino)ethyl ester hydrochloride Formula: C13H19ClN2O4 MolecularWeight: 302.75396

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNCCOC(=O)C1=CC(=CC=C1)[N+](=O)[O-].Cl

Isomeric SMILES

CC(C)CNCCOC(=O)C1=CC(=CC=C1)[N+](=O)[O-].Cl

InChI

InChI=1S/C13H18N2O4.ClH/c1-10(2)9-14-6-7-19-13(16)11-4-3-5-12(8-11)15(17)18;/h3-5,8,10,14H,6-7,9H2,1-2H3;1H