methyl (2R)-2-[(phenylmethyl)amino]-4-(3-phenyl-1H-pyrazol-5-yl)butanoate

Systemtic Name: methyl (2R)-2-[(phenylmethyl)amino]-4-(3-phenyl-1H-pyrazol-5-yl)butanoate Openeye Name: methyl (2R)-2-(benzylamino)-4-(3-phenyl-1H-pyrazol-5-yl)butanoate CAS Name: (2R)-2-[(phenylmethyl)amino]-4-(3-phenyl-1H-pyrazol-5-yl)butanoic acid methyl ester IUPAC Name: methyl (2R)-2-(benzylamino)-4-(3-phenyl-1H-pyrazol-5-yl)butanoate Traditional Name: (2R)-2-(benzylamino)-4-(3-phenyl-1H-pyrazol-5-yl)butyric acid methyl ester Formula: C21H23N3O2 MolecularWeight: 349.42622

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCC1=CC(=NN1)C2=CC=CC=C2)NCC3=CC=CC=C3

Isomeric SMILES

COC(=O)[C@@H](CCC1=CC(=NN1)C2=CC=CC=C2)NCC3=CC=CC=C3

InChI

InChI=1S/C21H23N3O2/c1-26-21(25)19(22-15-16-8-4-2-5-9-16)13-12-18-14-20(24-23-18)17-10-6-3-7-11-17/h2-11,14,19,22H,12-13,15H2,1H3,(H,23,24)/t19-/m1/s1