ethyl 3-[4-(2,6-naphthyridin-1-ylamino)phenyl]-2-[(3-oxidanylidene-5-propyl-cyclohexen-1-yl)amino]propanoate

Systemtic Name: ethyl 3-[4-(2,6-naphthyridin-1-ylamino)phenyl]-2-[(3-oxidanylidene-5-propyl-cyclohexen-1-yl)amino]propanoate Openeye Name: ethyl 3-[4-(2,6-naphthyridin-1-ylamino)phenyl]-2-[(3-oxo-5-propyl-cyclohexen-1-yl)amino]propanoate CAS Name: 3-[4-(2,6-naphthyridin-1-ylamino)phenyl]-2-[(3-oxo-5-propyl-1-cyclohexenyl)amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[4-(2,6-naphthyridin-1-ylamino)phenyl]-2-[(3-oxo-5-propylcyclohexen-1-yl)amino]propanoate Traditional Name: 2-[(3-keto-5-propyl-cyclohexen-1-yl)amino]-3-[4-(2,6-naphthyridin-1-ylamino)phenyl]propionic acid ethyl ester Formula: C28H32N4O3 MolecularWeight: 472.57868

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1CC(=CC(=O)C1)NC(CC2=CC=C(C=C2)NC3=NC=CC4=C3C=CN=C4)C(=O)OCC

Isomeric SMILES

CCCC1CC(=CC(=O)C1)NC(CC2=CC=C(C=C2)NC3=NC=CC4=C3C=CN=C4)C(=O)OCC

InChI

InChI=1S/C28H32N4O3/c1-3-5-20-14-23(17-24(33)15-20)31-26(28(34)35-4-2)16-19-6-8-22(9-7-19)32-27-25-11-12-29-18-21(25)10-13-30-27/h6-13,17-18,20,26,31H,3-5,14-16H2,1-2H3,(H,30,32)