(2S)-2-[(3-cyclopentyl-1-phenyl-pyrazol-4-yl)methylamino]-3-oxidanyl-propanoic acid

Systemtic Name: (2S)-2-[(3-cyclopentyl-1-phenyl-pyrazol-4-yl)methylamino]-3-oxidanyl-propanoic acid Openeye Name: (2S)-2-[(3-cyclopentyl-1-phenyl-pyrazol-4-yl)methylamino]-3-hydroxy-propanoic acid CAS Name: (2S)-2-[(3-cyclopentyl-1-phenyl-4-pyrazolyl)methylamino]-3-hydroxypropanoic acid IUPAC Name: (2S)-2-[(3-cyclopentyl-1-phenylpyrazol-4-yl)methylamino]-3-hydroxypropanoic acid Traditional Name: (2S)-2-[(3-cyclopentyl-1-phenyl-pyrazol-4-yl)methylamino]-3-hydroxy-propionic acid Formula: C18H18N3O3 MolecularWeight: 324.35382

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)[C]3[CH][CH][CH][CH]3)CNC(CO)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)[C]3[CH][CH][CH][CH]3)CN[C@@H](CO)C(=O)O

InChI

InChI=1S/C18H18N3O3/c22-12-16(18(23)24)19-10-14-11-21(15-8-2-1-3-9-15)20-17(14)13-6-4-5-7-13/h1-9,11,16,19,22H,10,12H2,(H,23,24)/t16-/m0/s1