3-(dipropylamino)propyl 4-nitrobenzoate hydrochloride

Systemtic Name: 3-(dipropylamino)propyl 4-nitrobenzoate hydrochloride Openeye Name: 3-(dipropylamino)propyl 4-nitrobenzoate hydrochloride CAS Name: 4-nitrobenzoic acid 3-(dipropylamino)propyl ester hydrochloride IUPAC Name: 3-(dipropylamino)propyl 4-nitrobenzoate hydrochloride Traditional Name: 4-nitrobenzoic acid 3-(dipropylamino)propyl ester hydrochloride Formula: C16H25ClN2O4 MolecularWeight: 344.8337

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)CCCOC(=O)C1=CC=C(C=C1)[N+](=O)[O-].Cl

Isomeric SMILES

CCCN(CCC)CCCOC(=O)C1=CC=C(C=C1)[N+](=O)[O-].Cl

InChI

InChI=1S/C16H24N2O4.ClH/c1-3-10-17(11-4-2)12-5-13-22-16(19)14-6-8-15(9-7-14)18(20)21;/h6-9H,3-5,10-13H2,1-2H3;1H