(2S)-3-(4-methoxyphenyl)-2-[(4-methylpiperazin-1-yl)carbonylamino]propanoic acid

Systemtic Name: (2S)-3-(4-methoxyphenyl)-2-[(4-methylpiperazin-1-yl)carbonylamino]propanoic acid Openeye Name: (2S)-3-(4-methoxyphenyl)-2-[(4-methylpiperazine-1-carbonyl)amino]propanoic acid CAS Name: (2S)-3-(4-methoxyphenyl)-2-[[(4-methyl-1-piperazinyl)-oxomethyl]amino]propanoic acid IUPAC Name: (2S)-3-(4-methoxyphenyl)-2-[(4-methylpiperazine-1-carbonyl)amino]propanoic acid Traditional Name: (2S)-3-(4-methoxyphenyl)-2-[(4-methylpiperazine-1-carbonyl)amino]propionic acid Formula: C16H23N3O4 MolecularWeight: 321.37152

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)NC(CC2=CC=C(C=C2)OC)C(=O)O

Isomeric SMILES

CN1CCN(CC1)C(=O)N[C@@H](CC2=CC=C(C=C2)OC)C(=O)O

InChI

InChI=1S/C16H23N3O4/c1-18-7-9-19(10-8-18)16(22)17-14(15(20)21)11-12-3-5-13(23-2)6-4-12/h3-6,14H,7-11H2,1-2H3,(H,17,22)(H,20,21)/t14-/m0/s1