methyl 4-[[[(1R)-1-(5-methyl-1-phenyl-pyrazol-4-yl)ethyl]amino]methyl]benzoate

Systemtic Name: methyl 4-[[[(1R)-1-(5-methyl-1-phenyl-pyrazol-4-yl)ethyl]amino]methyl]benzoate Openeye Name: methyl 4-[[[(1R)-1-(5-methyl-1-phenyl-pyrazol-4-yl)ethyl]amino]methyl]benzoate CAS Name: 4-[[[(1R)-1-(5-methyl-1-phenyl-4-pyrazolyl)ethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[(1R)-1-(5-methyl-1-phenylpyrazol-4-yl)ethyl]amino]methyl]benzoate Traditional Name: 4-[[[(1R)-1-(5-methyl-1-phenyl-pyrazol-4-yl)ethyl]amino]methyl]benzoic acid methyl ester Formula: C21H23N3O2 MolecularWeight: 349.42622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=CC=C2)C(C)NCC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC1=C(C=NN1C2=CC=CC=C2)[C@@H](C)NCC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C21H23N3O2/c1-15(22-13-17-9-11-18(12-10-17)21(25)26-3)20-14-23-24(16(20)2)19-7-5-4-6-8-19/h4-12,14-15,22H,13H2,1-3H3/t15-/m1/s1