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

Systemtic Name: 2-phenyl-3-[5-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)pentanoylamino]propanoic acid Openeye Name: 2-phenyl-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]-2-phenylpropanoic acid IUPAC Name: 2-phenyl-3-[5-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)pentanoylamino]propanoic acid Traditional Name: 2-phenyl-3-[5-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)pentanoylamino]propionic acid Formula: C22H27N3O3 MolecularWeight: 381.46808

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O3/c26-20(24-15-19(22(27)28)16-7-2-1-3-8-16)11-5-4-10-18-13-12-17-9-6-14-23-21(17)25-18/h1-3,7-8,12-13,19H,4-6,9-11,14-15H2,(H,23,25)(H,24,26)(H,27,28)