4-(diethylamino)-4-oxidanylidene-2-[(phenylmethyl)amino]butanoic acid

Systemtic Name: 4-(diethylamino)-4-oxidanylidene-2-[(phenylmethyl)amino]butanoic acid Openeye Name: 2-(benzylamino)-4-(diethylamino)-4-oxo-butanoic acid CAS Name: 4-(diethylamino)-4-oxo-2-[(phenylmethyl)amino]butanoic acid IUPAC Name: 2-(benzylamino)-4-(diethylamino)-4-oxobutanoic acid Traditional Name: 2-(benzylamino)-4-(diethylamino)-4-keto-butyric acid Formula: C15H22N2O3 MolecularWeight: 278.34678

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)CC(C(=O)O)NCC1=CC=CC=C1

Isomeric SMILES

CCN(CC)C(=O)CC(C(=O)O)NCC1=CC=CC=C1

InChI

InChI=1S/C15H22N2O3/c1-3-17(4-2)14(18)10-13(15(19)20)16-11-12-8-6-5-7-9-12/h5-9,13,16H,3-4,10-11H2,1-2H3,(H,19,20)