3-pyridin-3-yl-3-[5-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)pentanoylamino]propanoic acid

Systemtic Name: 3-pyridin-3-yl-3-[5-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)pentanoylamino]propanoic acid Openeye Name: 3-(3-pyridyl)-3-[5-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)pentanoylamino]propanoic acid CAS Name: 3-[[1-oxo-5-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)pentyl]amino]-3-(3-pyridinyl)propanoic acid IUPAC Name: 3-pyridin-3-yl-3-[5-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)pentanoylamino]propanoic acid Traditional Name: 3-(3-pyridyl)-3-[5-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)pentanoylamino]propionic 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)NC(CC(=O)O)C3=CN=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C21H26N4O3/c26-19(25-18(13-20(27)28)16-6-3-11-22-14-16)8-2-1-7-17-10-9-15-5-4-12-23-21(15)24-17/h3,6,9-11,14,18H,1-2,4-5,7-8,12-13H2,(H,23,24)(H,25,26)(H,27,28)