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

Systemtic Name: 5-oxidanylidene-2-pyrazin-2-yl-9-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)nonanoic acid Openeye Name: 5-oxo-2-pyrazin-2-yl-9-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)nonanoic acid CAS Name: 5-oxo-2-(2-pyrazinyl)-9-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)nonanoic acid IUPAC Name: 5-oxo-2-pyrazin-2-yl-9-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)nonanoic acid Traditional Name: 5-keto-2-pyrazin-2-yl-9-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)pelargonic acid Formula: C21H26N4O3 MolecularWeight: 382.45614

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(NC1)N=C(C=C2)CCCCC(=O)CCC(C3=NC=CN=C3)C(=O)O

Isomeric SMILES

C1CC2=C(NC1)N=C(C=C2)CCCCC(=O)CCC(C3=NC=CN=C3)C(=O)O

InChI

InChI=1S/C21H26N4O3/c26-17(9-10-18(21(27)28)19-14-22-12-13-23-19)6-2-1-5-16-8-7-15-4-3-11-24-20(15)25-16/h7-8,12-14,18H,1-6,9-11H2,(H,24,25)(H,27,28)