propan-2-yl 3-[[1-(2-nitrophenyl)piperidin-4-yl]carbonylamino]propanoate

Systemtic Name: propan-2-yl 3-[[1-(2-nitrophenyl)piperidin-4-yl]carbonylamino]propanoate Openeye Name: isopropyl 3-[[1-(2-nitrophenyl)piperidine-4-carbonyl]amino]propanoate CAS Name: 3-[[[1-(2-nitrophenyl)-4-piperidinyl]-oxomethyl]amino]propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-[[1-(2-nitrophenyl)piperidine-4-carbonyl]amino]propanoate Traditional Name: 3-[[1-(2-nitrophenyl)isonipecotoyl]amino]propionic acid isopropyl ester Formula: C18H25N3O5 MolecularWeight: 363.4082

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CCNC(=O)C1CCN(CC1)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC(C)OC(=O)CCNC(=O)C1CCN(CC1)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C18H25N3O5/c1-13(2)26-17(22)7-10-19-18(23)14-8-11-20(12-9-14)15-5-3-4-6-16(15)21(24)25/h3-6,13-14H,7-12H2,1-2H3,(H,19,23)