3-[(5-cyanofuran-2-yl)carbonylamino]-4-piperidin-1-yl-benzoic acid

Systemtic Name: 3-[(5-cyanofuran-2-yl)carbonylamino]-4-piperidin-1-yl-benzoic acid Openeye Name: 3-[(5-cyanofuran-2-carbonyl)amino]-4-(1-piperidyl)benzoic acid CAS Name: 3-[[(5-cyano-2-furanyl)-oxomethyl]amino]-4-(1-piperidinyl)benzoic acid IUPAC Name: 3-[(5-cyanofuran-2-carbonyl)amino]-4-piperidin-1-ylbenzoic acid Traditional Name: 3-[(5-cyano-2-furoyl)amino]-4-piperidino-benzoic acid Formula: C18H17N3O4 MolecularWeight: 339.34528

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)O)NC(=O)C3=CC=C(O3)C#N

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)O)NC(=O)C3=CC=C(O3)C#N

InChI

InChI=1S/C18H17N3O4/c19-11-13-5-7-16(25-13)17(22)20-14-10-12(18(23)24)4-6-15(14)21-8-2-1-3-9-21/h4-7,10H,1-3,8-9H2,(H,20,22)(H,23,24)