4-[(2-cyanophenyl)amino]-2-(3-morpholin-4-ylpropylamino)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(2-cyanophenyl)amino]-2-(3-morpholin-4-ylpropylamino)-4-oxidanylidene-butanoic acid Openeye Name: 4-(2-cyanoanilino)-2-(3-morpholinopropylamino)-4-oxo-butanoic acid CAS Name: 4-(2-cyanoanilino)-2-[3-(4-morpholinyl)propylamino]-4-oxobutanoic acid IUPAC Name: 4-(2-cyanoanilino)-2-(3-morpholin-4-ylpropylamino)-4-oxobutanoic acid Traditional Name: 4-(2-cyanoanilino)-4-keto-2-(3-morpholinopropylamino)butyric acid Formula: C18H24N4O4 MolecularWeight: 360.40756

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCNC(CC(=O)NC2=CC=CC=C2C#N)C(=O)O

Isomeric SMILES

C1COCCN1CCCNC(CC(=O)NC2=CC=CC=C2C#N)C(=O)O

InChI

InChI=1S/C18H24N4O4/c19-13-14-4-1-2-5-15(14)21-17(23)12-16(18(24)25)20-6-3-7-22-8-10-26-11-9-22/h1-2,4-5,16,20H,3,6-12H2,(H,21,23)(H,24,25)