2-[methyl-[4-(phenylmethyl)piperazin-1-yl]carbonyl-amino]ethanoic acid

Systemtic Name: 2-[methyl-[4-(phenylmethyl)piperazin-1-yl]carbonyl-amino]ethanoic acid Openeye Name: 2-[(4-benzylpiperazine-1-carbonyl)-methyl-amino]acetic acid CAS Name: 2-[methyl-[oxo-[4-(phenylmethyl)-1-piperazinyl]methyl]amino]acetic acid IUPAC Name: 2-[(4-benzylpiperazine-1-carbonyl)-methylamino]acetic acid Traditional Name: 2-[(4-benzylpiperazine-1-carbonyl)-methyl-amino]acetic acid Formula: C15H21N3O3 MolecularWeight: 291.34554

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)O)C(=O)N1CCN(CC1)CC2=CC=CC=C2

Isomeric SMILES

CN(CC(=O)O)C(=O)N1CCN(CC1)CC2=CC=CC=C2

InChI

InChI=1S/C15H21N3O3/c1-16(12-14(19)20)15(21)18-9-7-17(8-10-18)11-13-5-3-2-4-6-13/h2-6H,7-12H2,1H3,(H,19,20)