2-(1-benzothiophen-2-yl)-9-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)nonanoic acid

Systemtic Name: 2-(1-benzothiophen-2-yl)-9-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)nonanoic acid Openeye Name: 2-(benzothiophen-2-yl)-9-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)nonanoic acid CAS Name: 2-(1-benzothiophen-2-yl)-9-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)nonanoic acid IUPAC Name: 2-(1-benzothiophen-2-yl)-9-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)nonanoic acid Traditional Name: 2-(benzothiophen-2-yl)-9-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)pelargonic acid Formula: C25H30N2O2S MolecularWeight: 422.5829

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(NC1)N=C(C=C2)CCCCCCCC(C3=CC4=CC=CC=C4S3)C(=O)O

Isomeric SMILES

C1CC2=C(NC1)N=C(C=C2)CCCCCCCC(C3=CC4=CC=CC=C4S3)C(=O)O

InChI

InChI=1S/C25H30N2O2S/c28-25(29)21(23-17-19-9-6-7-13-22(19)30-23)12-5-3-1-2-4-11-20-15-14-18-10-8-16-26-24(18)27-20/h6-7,9,13-15,17,21H,1-5,8,10-12,16H2,(H,26,27)(H,28,29)