4-[8-[(6-azanylhexanoylamino)methyl]imidazo[1,2-a]pyridin-2-yl]benzoic acid

Systemtic Name: 4-[8-[(6-azanylhexanoylamino)methyl]imidazo[1,2-a]pyridin-2-yl]benzoic acid Openeye Name: 4-[8-[(6-aminohexanoylamino)methyl]imidazo[1,2-a]pyridin-2-yl]benzoic acid CAS Name: 4-[8-[[(6-amino-1-oxohexyl)amino]methyl]-2-imidazo[1,2-a]pyridinyl]benzoic acid IUPAC Name: 4-[8-[(6-aminohexanoylamino)methyl]imidazo[1,2-a]pyridin-2-yl]benzoic acid Traditional Name: 4-[8-[(6-aminohexanoylamino)methyl]imidazo[1,2-a]pyridin-2-yl]benzoic acid Formula: C21H24N4O3 MolecularWeight: 380.44026

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN2C=C(N=C2C(=C1)CNC(=O)CCCCCN)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C1=CN2C=C(N=C2C(=C1)CNC(=O)CCCCCN)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C21H24N4O3/c22-11-3-1-2-6-19(26)23-13-17-5-4-12-25-14-18(24-20(17)25)15-7-9-16(10-8-15)21(27)28/h4-5,7-10,12,14H,1-3,6,11,13,22H2,(H,23,26)(H,27,28)