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

Systemtic Name: 5-oxidanylidene-2-pyrimidin-5-yl-9-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)nonanoic acid Openeye Name: 5-oxo-2-pyrimidin-5-yl-9-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)nonanoic acid CAS Name: 5-oxo-2-(5-pyrimidinyl)-9-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)nonanoic acid IUPAC Name: 5-oxo-2-pyrimidin-5-yl-9-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)nonanoic acid Traditional Name: 5-keto-2-(5-pyrimidyl)-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=CN=CN=C3)C(=O)O

Isomeric SMILES

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

InChI

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