propan-2-yl 3-[(4-methylpiperidin-1-yl)sulfonylamino]-3-(2-nitrophenyl)propanoate

Systemtic Name: propan-2-yl 3-[(4-methylpiperidin-1-yl)sulfonylamino]-3-(2-nitrophenyl)propanoate Openeye Name: isopropyl 3-[(4-methyl-1-piperidyl)sulfonylamino]-3-(2-nitrophenyl)propanoate CAS Name: 3-[(4-methyl-1-piperidinyl)sulfonylamino]-3-(2-nitrophenyl)propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-[(4-methylpiperidin-1-yl)sulfonylamino]-3-(2-nitrophenyl)propanoate Traditional Name: 3-[(4-methylpiperidino)sulfonylamino]-3-(2-nitrophenyl)propionic acid isopropyl ester Formula: C18H27N3O6S MolecularWeight: 413.48848

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)NC(CC(=O)OC(C)C)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)NC(CC(=O)OC(C)C)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C18H27N3O6S/c1-13(2)27-18(22)12-16(15-6-4-5-7-17(15)21(23)24)19-28(25,26)20-10-8-14(3)9-11-20/h4-7,13-14,16,19H,8-12H2,1-3H3