methyl 2-[(3-nitro-4-piperidin-1-yl-phenyl)carbonylamino]thiophene-3-carboxylate

Systemtic Name: methyl 2-[(3-nitro-4-piperidin-1-yl-phenyl)carbonylamino]thiophene-3-carboxylate Openeye Name: methyl 2-[[3-nitro-4-(1-piperidyl)benzoyl]amino]thiophene-3-carboxylate CAS Name: 2-[[[3-nitro-4-(1-piperidinyl)phenyl]-oxomethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(3-nitro-4-piperidin-1-ylbenzoyl)amino]thiophene-3-carboxylate Traditional Name: 2-[(3-nitro-4-piperidino-benzoyl)amino]thiophene-3-carboxylic acid methyl ester Formula: C18H19N3O5S MolecularWeight: 389.42556

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC=C1)NC(=O)C2=CC(=C(C=C2)N3CCCCC3)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=C(SC=C1)NC(=O)C2=CC(=C(C=C2)N3CCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C18H19N3O5S/c1-26-18(23)13-7-10-27-17(13)19-16(22)12-5-6-14(15(11-12)21(24)25)20-8-3-2-4-9-20/h5-7,10-11H,2-4,8-9H2,1H3,(H,19,22)