3-[4-(2,6-naphthyridin-1-ylamino)phenyl]-2-[(3-oxidanylidene-2-propan-2-yl-cyclopenten-1-yl)amino]propanoic acid

Systemtic Name: 3-[4-(2,6-naphthyridin-1-ylamino)phenyl]-2-[(3-oxidanylidene-2-propan-2-yl-cyclopenten-1-yl)amino]propanoic acid Openeye Name: 2-[(2-isopropyl-3-oxo-cyclopenten-1-yl)amino]-3-[4-(2,6-naphthyridin-1-ylamino)phenyl]propanoic acid CAS Name: 3-[4-(2,6-naphthyridin-1-ylamino)phenyl]-2-[(3-oxo-2-propan-2-yl-1-cyclopentenyl)amino]propanoic acid IUPAC Name: 3-[4-(2,6-naphthyridin-1-ylamino)phenyl]-2-[(3-oxo-2-propan-2-ylcyclopenten-1-yl)amino]propanoic acid Traditional Name: 2-[(2-isopropyl-3-keto-cyclopenten-1-yl)amino]-3-[4-(2,6-naphthyridin-1-ylamino)phenyl]propionic acid Formula: C25H26N4O3 MolecularWeight: 430.49894

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(CCC1=O)NC(CC2=CC=C(C=C2)NC3=NC=CC4=C3C=CN=C4)C(=O)O

Isomeric SMILES

CC(C)C1=C(CCC1=O)NC(CC2=CC=C(C=C2)NC3=NC=CC4=C3C=CN=C4)C(=O)O

InChI

InChI=1S/C25H26N4O3/c1-15(2)23-20(7-8-22(23)30)29-21(25(31)32)13-16-3-5-18(6-4-16)28-24-19-10-11-26-14-17(19)9-12-27-24/h3-6,9-12,14-15,21,29H,7-8,13H2,1-2H3,(H,27,28)(H,31,32)