2-(butylamino)ethyl 4-nitrobenzoate hydrochloride

Systemtic Name: 2-(butylamino)ethyl 4-nitrobenzoate hydrochloride Openeye Name: 2-(butylamino)ethyl 4-nitrobenzoate hydrochloride CAS Name: 4-nitrobenzoic acid 2-(butylamino)ethyl ester hydrochloride IUPAC Name: 2-(butylamino)ethyl 4-nitrobenzoate hydrochloride Traditional Name: 4-nitrobenzoic acid 2-(butylamino)ethyl ester hydrochloride Formula: C13H19ClN2O4 MolecularWeight: 302.75396

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18N2O4.ClH/c1-2-3-8-14-9-10-19-13(16)11-4-6-12(7-5-11)15(17)18;/h4-7,14H,2-3,8-10H2,1H3;1H