(2S)-4-methyl-2-[(4-phenylpiperazin-1-yl)carbonylamino]pentanoate

Systemtic Name: (2S)-4-methyl-2-[(4-phenylpiperazin-1-yl)carbonylamino]pentanoate Openeye Name: (2S)-4-methyl-2-[(4-phenylpiperazine-1-carbonyl)amino]pentanoate CAS Name: (2S)-4-methyl-2-[[oxo-(4-phenyl-1-piperazinyl)methyl]amino]pentanoate IUPAC Name: (2S)-4-methyl-2-[(4-phenylpiperazine-1-carbonyl)amino]pentanoate Traditional Name: (2S)-4-methyl-2-[(4-phenylpiperazine-1-carbonyl)amino]valerate Formula: C17H24N3O3- MolecularWeight: 318.39076

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)[O-])NC(=O)N1CCN(CC1)C2=CC=CC=C2

Isomeric SMILES

CC(C)C[C@@H](C(=O)[O-])NC(=O)N1CCN(CC1)C2=CC=CC=C2

InChI

InChI=1S/C17H25N3O3/c1-13(2)12-15(16(21)22)18-17(23)20-10-8-19(9-11-20)14-6-4-3-5-7-14/h3-7,13,15H,8-12H2,1-2H3,(H,18,23)(H,21,22)/p-1/t15-/m0/s1