methyl 2-[[4-(3,5-dimethylpiperidin-1-yl)-3-nitro-phenyl]carbonylamino]-2-methyl-propanoate

Systemtic Name: methyl 2-[[4-(3,5-dimethylpiperidin-1-yl)-3-nitro-phenyl]carbonylamino]-2-methyl-propanoate Openeye Name: methyl 2-[[4-(3,5-dimethyl-1-piperidyl)-3-nitro-benzoyl]amino]-2-methyl-propanoate CAS Name: 2-[[[4-(3,5-dimethyl-1-piperidinyl)-3-nitrophenyl]-oxomethyl]amino]-2-methylpropanoic acid methyl ester IUPAC Name: methyl 2-[[4-(3,5-dimethylpiperidin-1-yl)-3-nitrobenzoyl]amino]-2-methylpropanoate Traditional Name: 2-[[4-(3,5-dimethylpiperidino)-3-nitro-benzoyl]amino]-2-methyl-propionic acid methyl ester Formula: C19H27N3O5 MolecularWeight: 377.43478

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C2=C(C=C(C=C2)C(=O)NC(C)(C)C(=O)OC)[N+](=O)[O-])C

Isomeric SMILES

CC1CC(CN(C1)C2=C(C=C(C=C2)C(=O)NC(C)(C)C(=O)OC)[N+](=O)[O-])C

InChI

InChI=1S/C19H27N3O5/c1-12-8-13(2)11-21(10-12)15-7-6-14(9-16(15)22(25)26)17(23)20-19(3,4)18(24)27-5/h6-7,9,12-13H,8,10-11H2,1-5H3,(H,20,23)