(2R)-4-[(4-dimethylaminophenyl)amino]-2-(2-methoxyethylazaniumyl)-4-oxidanylidene-butanoate

Systemtic Name: (2R)-4-[(4-dimethylaminophenyl)amino]-2-(2-methoxyethylazaniumyl)-4-oxidanylidene-butanoate Openeye Name: (2R)-4-[4-(dimethylamino)anilino]-2-(2-methoxyethylammonio)-4-oxo-butanoate CAS Name: (2R)-4-[4-(dimethylamino)anilino]-2-(2-methoxyethylammonio)-4-oxobutanoate IUPAC Name: (2R)-4-[4-(dimethylamino)anilino]-2-(2-methoxyethylazaniumyl)-4-oxobutanoate Traditional Name: (2R)-4-[4-(dimethylamino)anilino]-4-keto-2-(2-methoxyethylammonio)butyrate Formula: C15H23N3O4 MolecularWeight: 309.36082

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)NC(=O)CC(C(=O)[O-])[NH2+]CCOC

Isomeric SMILES

CN(C)C1=CC=C(C=C1)NC(=O)C[C@H](C(=O)[O-])[NH2+]CCOC

InChI

InChI=1S/C15H23N3O4/c1-18(2)12-6-4-11(5-7-12)17-14(19)10-13(15(20)21)16-8-9-22-3/h4-7,13,16H,8-10H2,1-3H3,(H,17,19)(H,20,21)/t13-/m1/s1