5-[(2-cyanopyridin-4-yl)methyl]-7,8,9,10-tetrahydro-6H-cyclohepta[b]indole-4-carboxylic acid

Systemtic Name: 5-[(2-cyanopyridin-4-yl)methyl]-7,8,9,10-tetrahydro-6H-cyclohepta[b]indole-4-carboxylic acid Openeye Name: 5-[(2-cyano-4-pyridyl)methyl]-7,8,9,10-tetrahydro-6H-cyclohepta[b]indole-4-carboxylic acid CAS Name: 5-[(2-cyano-4-pyridinyl)methyl]-7,8,9,10-tetrahydro-6H-cyclohepta[b]indole-4-carboxylic acid IUPAC Name: 5-[(2-cyanopyridin-4-yl)methyl]-7,8,9,10-tetrahydro-6H-cyclohepta[b]indole-4-carboxylic acid Traditional Name: 5-[(2-cyano-4-pyridyl)methyl]-7,8,9,10-tetrahydro-6H-cyclohept[b]indole-4-carboxylic acid Formula: C21H19N3O2 MolecularWeight: 345.39446

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(CC1)N(C3=C2C=CC=C3C(=O)O)CC4=CC(=NC=C4)C#N

Isomeric SMILES

C1CCC2=C(CC1)N(C3=C2C=CC=C3C(=O)O)CC4=CC(=NC=C4)C#N

InChI

InChI=1S/C21H19N3O2/c22-12-15-11-14(9-10-23-15)13-24-19-8-3-1-2-5-16(19)17-6-4-7-18(20(17)24)21(25)26/h4,6-7,9-11H,1-3,5,8,13H2,(H,25,26)