3-(3-methylphenyl)-4-[3-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]-1,2,4-oxadiazol-5-yl]butanoic acid hydrochloride

Systemtic Name: 3-(3-methylphenyl)-4-[3-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]-1,2,4-oxadiazol-5-yl]butanoic acid hydrochloride Openeye Name: 3-(m-tolyl)-4-[3-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]-1,2,4-oxadiazol-5-yl]butanoic acid hydrochloride CAS Name: 3-(3-methylphenyl)-4-[3-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]-1,2,4-oxadiazol-5-yl]butanoic acid hydrochloride IUPAC Name: 3-(3-methylphenyl)-4-[3-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]-1,2,4-oxadiazol-5-yl]butanoic acid hydrochloride Traditional Name: 3-(m-tolyl)-4-[3-[3-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)propyl]-1,2,4-oxadiazol-5-yl]butyric acid hydrochloride Formula: C24H29ClN4O3 MolecularWeight: 456.96506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(CC2=NC(=NO2)CCCC3=NC4=C(CCCN4)C=C3)CC(=O)O.Cl

Isomeric SMILES

CC1=CC(=CC=C1)C(CC2=NC(=NO2)CCCC3=NC4=C(CCCN4)C=C3)CC(=O)O.Cl

InChI

InChI=1S/C24H28N4O3.ClH/c1-16-5-2-6-18(13-16)19(15-23(29)30)14-22-27-21(28-31-22)9-3-8-20-11-10-17-7-4-12-25-24(17)26-20;/h2,5-6,10-11,13,19H,3-4,7-9,12,14-15H2,1H3,(H,25,26)(H,29,30);1H