methyl 3-[(3-nitro-4-piperidin-1-yl-phenyl)carbonyl-pyridin-2-yl-amino]propanoate

Systemtic Name: methyl 3-[(3-nitro-4-piperidin-1-yl-phenyl)carbonyl-pyridin-2-yl-amino]propanoate Openeye Name: methyl 3-[[3-nitro-4-(1-piperidyl)benzoyl]-(2-pyridyl)amino]propanoate CAS Name: 3-[[[3-nitro-4-(1-piperidinyl)phenyl]-oxomethyl]-(2-pyridinyl)amino]propanoic acid methyl ester IUPAC Name: methyl 3-[(3-nitro-4-piperidin-1-ylbenzoyl)-pyridin-2-ylamino]propanoate Traditional Name: 3-[(3-nitro-4-piperidino-benzoyl)-(2-pyridyl)amino]propionic acid methyl ester Formula: C21H24N4O5 MolecularWeight: 412.43906

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCN(C1=CC=CC=N1)C(=O)C2=CC(=C(C=C2)N3CCCCC3)[N+](=O)[O-]

Isomeric SMILES

COC(=O)CCN(C1=CC=CC=N1)C(=O)C2=CC(=C(C=C2)N3CCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C21H24N4O5/c1-30-20(26)10-14-24(19-7-3-4-11-22-19)21(27)16-8-9-17(18(15-16)25(28)29)23-12-5-2-6-13-23/h3-4,7-9,11,15H,2,5-6,10,12-14H2,1H3