4-[(3-methylphenyl)amino]-2-(2-morpholin-4-ylethylamino)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(3-methylphenyl)amino]-2-(2-morpholin-4-ylethylamino)-4-oxidanylidene-butanoic acid Openeye Name: 4-(3-methylanilino)-2-(2-morpholinoethylamino)-4-oxo-butanoic acid CAS Name: 4-(3-methylanilino)-2-[2-(4-morpholinyl)ethylamino]-4-oxobutanoic acid IUPAC Name: 4-(3-methylanilino)-2-(2-morpholin-4-ylethylamino)-4-oxobutanoic acid Traditional Name: 4-keto-2-(2-morpholinoethylamino)-4-(m-toluidino)butyric acid Formula: C17H25N3O4 MolecularWeight: 335.3981

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CC(C(=O)O)NCCN2CCOCC2

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CC(C(=O)O)NCCN2CCOCC2

InChI

InChI=1S/C17H25N3O4/c1-13-3-2-4-14(11-13)19-16(21)12-15(17(22)23)18-5-6-20-7-9-24-10-8-20/h2-4,11,15,18H,5-10,12H2,1H3,(H,19,21)(H,22,23)