(4-nitrophenyl) N-(2-oxidanylidene-2-pyrrolidin-2-yl-ethyl)-N-prop-2-ynyl-carbamate hydrochloride

Systemtic Name: (4-nitrophenyl) N-(2-oxidanylidene-2-pyrrolidin-2-yl-ethyl)-N-prop-2-ynyl-carbamate hydrochloride Openeye Name: (4-nitrophenyl) N-(2-oxo-2-pyrrolidin-2-yl-ethyl)-N-prop-2-ynyl-carbamate hydrochloride CAS Name: N-[2-oxo-2-(2-pyrrolidinyl)ethyl]-N-prop-2-ynylcarbamic acid (4-nitrophenyl) ester hydrochloride IUPAC Name: (4-nitrophenyl) N-(2-oxo-2-pyrrolidin-2-ylethyl)-N-prop-2-ynylcarbamate hydrochloride Traditional Name: N-(2-keto-2-pyrrolidin-2-yl-ethyl)-N-propargyl-carbamic acid (4-nitrophenyl) ester hydrochloride Formula: C16H18ClN3O5 MolecularWeight: 367.78422

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN(CC(=O)C1CCCN1)C(=O)OC2=CC=C(C=C2)[N+](=O)[O-].Cl

Isomeric SMILES

C#CCN(CC(=O)C1CCCN1)C(=O)OC2=CC=C(C=C2)[N+](=O)[O-].Cl

InChI

InChI=1S/C16H17N3O5.ClH/c1-2-10-18(11-15(20)14-4-3-9-17-14)16(21)24-13-7-5-12(6-8-13)19(22)23;/h1,5-8,14,17H,3-4,9-11H2;1H