(1-phenyl-2-pyrrolidin-1-yl-ethyl) 4-nitrobenzoate hydrochloride

Systemtic Name: (1-phenyl-2-pyrrolidin-1-yl-ethyl) 4-nitrobenzoate hydrochloride Openeye Name: (1-phenyl-2-pyrrolidin-1-yl-ethyl) 4-nitrobenzoate hydrochloride CAS Name: 4-nitrobenzoic acid [1-phenyl-2-(1-pyrrolidinyl)ethyl] ester hydrochloride IUPAC Name: (1-phenyl-2-pyrrolidin-1-ylethyl) 4-nitrobenzoate hydrochloride Traditional Name: 4-nitrobenzoic acid (1-phenyl-2-pyrrolidino-ethyl) ester hydrochloride Formula: C19H21ClN2O4 MolecularWeight: 376.83404

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC(C2=CC=CC=C2)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-].Cl

Isomeric SMILES

C1CCN(C1)CC(C2=CC=CC=C2)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-].Cl

InChI

InChI=1S/C19H20N2O4.ClH/c22-19(16-8-10-17(11-9-16)21(23)24)25-18(14-20-12-4-5-13-20)15-6-2-1-3-7-15;/h1-3,6-11,18H,4-5,12-14H2;1H