5-[(2-azanyl-5-cyano-pyridin-4-yl)-methyl-amino]indole-1-carboxylic acid

Systemtic Name: 5-[(2-azanyl-5-cyano-pyridin-4-yl)-methyl-amino]indole-1-carboxylic acid Openeye Name: 5-[(2-amino-5-cyano-4-pyridyl)-methyl-amino]indole-1-carboxylic acid CAS Name: 5-[(2-amino-5-cyano-4-pyridinyl)-methylamino]-1-indolecarboxylic acid IUPAC Name: 5-[(2-amino-5-cyanopyridin-4-yl)-methylamino]indole-1-carboxylic acid Traditional Name: 5-[(2-amino-5-cyano-4-pyridyl)-methyl-amino]indole-1-carboxylic acid Formula: C16H13N5O2 MolecularWeight: 307.30672

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC2=C(C=C1)N(C=C2)C(=O)O)C3=CC(=NC=C3C#N)N

Isomeric SMILES

CN(C1=CC2=C(C=C1)N(C=C2)C(=O)O)C3=CC(=NC=C3C#N)N

InChI

InChI=1S/C16H13N5O2/c1-20(14-7-15(18)19-9-11(14)8-17)12-2-3-13-10(6-12)4-5-21(13)16(22)23/h2-7,9H,1H3,(H2,18,19)(H,22,23)