2-[1-(pyridin-2-ylmethyl)-3,4-dihydropyrimido[1,6-a]indol-5-yl]ethanoic acid

Systemtic Name: 2-[1-(pyridin-2-ylmethyl)-3,4-dihydropyrimido[1,6-a]indol-5-yl]ethanoic acid Openeye Name: 2-[1-(2-pyridylmethyl)-3,4-dihydropyrimido[1,6-a]indol-5-yl]acetic acid CAS Name: 2-[1-(2-pyridinylmethyl)-3,4-dihydropyrimido[1,6-a]indol-5-yl]acetic acid IUPAC Name: 2-[1-(pyridin-2-ylmethyl)-3,4-dihydropyrimido[1,6-a]indol-5-yl]acetic acid Traditional Name: 2-[1-(2-pyridylmethyl)-3,4-dihydropyrimid[1,6-a]indol-5-yl]acetic acid Formula: C19H17N3O2 MolecularWeight: 319.35718

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Descriptors Computed from Structure

Canonical SMILES:

C1CN=C(N2C1=C(C3=CC=CC=C32)CC(=O)O)CC4=CC=CC=N4

Isomeric SMILES

C1CN=C(N2C1=C(C3=CC=CC=C32)CC(=O)O)CC4=CC=CC=N4

InChI

InChI=1S/C19H17N3O2/c23-19(24)12-15-14-6-1-2-7-16(14)22-17(15)8-10-21-18(22)11-13-5-3-4-9-20-13/h1-7,9H,8,10-12H2,(H,23,24)