2-[4-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]piperazin-1-yl]ethanoic acid

Systemtic Name: 2-[4-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]piperazin-1-yl]ethanoic acid Openeye Name: 2-[4-[2-(2,6-dimethylanilino)-2-oxo-ethyl]piperazin-1-yl]acetic acid CAS Name: 2-[4-[2-(2,6-dimethylanilino)-2-oxoethyl]-1-piperazinyl]acetic acid IUPAC Name: 2-[4-[2-(2,6-dimethylanilino)-2-oxoethyl]piperazin-1-yl]acetic acid Traditional Name: 2-[4-[2-(2,6-dimethylanilino)-2-keto-ethyl]piperazino]acetic acid Formula: C16H23N3O3 MolecularWeight: 305.37212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CN2CCN(CC2)CC(=O)O

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CN2CCN(CC2)CC(=O)O

InChI

InChI=1S/C16H23N3O3/c1-12-4-3-5-13(2)16(12)17-14(20)10-18-6-8-19(9-7-18)11-15(21)22/h3-5H,6-11H2,1-2H3,(H,17,20)(H,21,22)