ethyl 4-(6-azanyl-3-oxidanylidene-1H-isoindol-2-yl)-5-[(1-ethoxy-1-oxidanylidene-3-phenyl-propan-2-yl)amino]-5-oxidanylidene-pentanoate

Systemtic Name: ethyl 4-(6-azanyl-3-oxidanylidene-1H-isoindol-2-yl)-5-[(1-ethoxy-1-oxidanylidene-3-phenyl-propan-2-yl)amino]-5-oxidanylidene-pentanoate Openeye Name: ethyl 4-(5-amino-1-oxo-isoindolin-2-yl)-5-[(1-benzyl-2-ethoxy-2-oxo-ethyl)amino]-5-oxo-pentanoate CAS Name: 4-(6-amino-3-oxo-1H-isoindol-2-yl)-5-[(1-ethoxy-1-oxo-3-phenylpropan-2-yl)amino]-5-oxopentanoic acid ethyl ester IUPAC Name: ethyl 4-(6-amino-3-oxo-1H-isoindol-2-yl)-5-[(1-ethoxy-1-oxo-3-phenylpropan-2-yl)amino]-5-oxopentanoate Traditional Name: 4-(5-amino-1-keto-isoindolin-2-yl)-5-[(1-benzyl-2-ethoxy-2-keto-ethyl)amino]-5-keto-valeric acid ethyl ester Formula: C26H31N3O6 MolecularWeight: 481.54084

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(C(=O)NC(CC1=CC=CC=C1)C(=O)OCC)N2CC3=C(C2=O)C=CC(=C3)N

Isomeric SMILES

CCOC(=O)CCC(C(=O)NC(CC1=CC=CC=C1)C(=O)OCC)N2CC3=C(C2=O)C=CC(=C3)N

InChI

InChI=1S/C26H31N3O6/c1-3-34-23(30)13-12-22(29-16-18-15-19(27)10-11-20(18)25(29)32)24(31)28-21(26(33)35-4-2)14-17-8-6-5-7-9-17/h5-11,15,21-22H,3-4,12-14,16,27H2,1-2H3,(H,28,31)