2-(2-morpholin-4-ylethylamino)-4-(naphthalen-2-ylamino)-4-oxidanylidene-butanoic acid

Systemtic Name: 2-(2-morpholin-4-ylethylamino)-4-(naphthalen-2-ylamino)-4-oxidanylidene-butanoic acid Openeye Name: 2-(2-morpholinoethylamino)-4-(2-naphthylamino)-4-oxo-butanoic acid CAS Name: 2-[2-(4-morpholinyl)ethylamino]-4-(2-naphthalenylamino)-4-oxobutanoic acid IUPAC Name: 2-(2-morpholin-4-ylethylamino)-4-(naphthalen-2-ylamino)-4-oxobutanoic acid Traditional Name: 4-keto-2-(2-morpholinoethylamino)-4-(2-naphthylamino)butyric acid Formula: C20H25N3O4 MolecularWeight: 371.4302

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCNC(CC(=O)NC2=CC3=CC=CC=C3C=C2)C(=O)O

Isomeric SMILES

C1COCCN1CCNC(CC(=O)NC2=CC3=CC=CC=C3C=C2)C(=O)O

InChI

InChI=1S/C20H25N3O4/c24-19(22-17-6-5-15-3-1-2-4-16(15)13-17)14-18(20(25)26)21-7-8-23-9-11-27-12-10-23/h1-6,13,18,21H,7-12,14H2,(H,22,24)(H,25,26)