sodium N-(2-aminocarbonyl-3-piperidin-1-yl-phenyl)-1,2,3-triaza-4-azanidacyclopenta-2,5-diene-5-carboxamide

Systemtic Name: sodium N-(2-aminocarbonyl-3-piperidin-1-yl-phenyl)-1,2,3-triaza-4-azanidacyclopenta-2,5-diene-5-carboxamide Openeye Name: sodium N-[2-carbamoyl-3-(1-piperidyl)phenyl]-1,2,3-triaza-4-azanidacyclopenta-2,5-diene-5-carboxamide CAS Name: sodium N-[2-carbamoyl-3-(1-piperidinyl)phenyl]-1,2,3-triaza-4-azanidacyclopenta-2,5-diene-5-carboxamide IUPAC Name: sodium N-(2-carbamoyl-3-piperidin-1-ylphenyl)-1,2,3-triaza-4-azanidacyclopenta-2,5-diene-5-carboxamide Traditional Name: sodium N-(2-carbamoyl-3-piperidino-phenyl)-1,2,3-triaza-4-azanidacyclopenta-2,5-diene-5-carboxamide Formula: C14H16N7NaO2 MolecularWeight: 337.31231

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C(=CC=C2)NC(=O)C3=NN=N[N-]3)C(=O)N.[Na+]

Isomeric SMILES

C1CCN(CC1)C2=C(C(=CC=C2)NC(=O)C3=NN=N[N-]3)C(=O)N.[Na+]

InChI

InChI=1S/C14H17N7O2.Na/c15-12(22)11-9(16-14(23)13-17-19-20-18-13)5-4-6-10(11)21-7-2-1-3-8-21;/h4-6H,1-3,7-8H2,(H4,15,16,17,18,19,20,22,23);/q;+1/p-1