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

Systemtic Name: 5-[(2-aminocarbonylpyridin-4-yl)methyl]-7,8,9,10-tetrahydro-6H-cyclohepta[b]indole-4-carboxylic acid Openeye Name: 5-[(2-carbamoyl-4-pyridyl)methyl]-7,8,9,10-tetrahydro-6H-cyclohepta[b]indole-4-carboxylic acid CAS Name: 5-[(2-carbamoyl-4-pyridinyl)methyl]-7,8,9,10-tetrahydro-6H-cyclohepta[b]indole-4-carboxylic acid IUPAC Name: 5-[(2-carbamoylpyridin-4-yl)methyl]-7,8,9,10-tetrahydro-6H-cyclohepta[b]indole-4-carboxylic acid Traditional Name: 5-[(2-carbamoyl-4-pyridyl)methyl]-7,8,9,10-tetrahydro-6H-cyclohept[b]indole-4-carboxylic acid Formula: C21H21N3O3 MolecularWeight: 363.40974

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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(=O)N

Isomeric SMILES

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

InChI

InChI=1S/C21H21N3O3/c22-20(25)17-11-13(9-10-23-17)12-24-18-8-3-1-2-5-14(18)15-6-4-7-16(19(15)24)21(26)27/h4,6-7,9-11H,1-3,5,8,12H2,(H2,22,25)(H,26,27)