methyl (2R)-2-[[3-(3,4-dimethylphenyl)-1-(phenylmethyl)pyrazol-4-yl]carbonylamino]-3-oxidanyl-propanoate

Systemtic Name: methyl (2R)-2-[[3-(3,4-dimethylphenyl)-1-(phenylmethyl)pyrazol-4-yl]carbonylamino]-3-oxidanyl-propanoate Openeye Name: methyl (2R)-2-[[1-benzyl-3-(3,4-dimethylphenyl)pyrazole-4-carbonyl]amino]-3-hydroxy-propanoate CAS Name: (2R)-2-[[[3-(3,4-dimethylphenyl)-1-(phenylmethyl)-4-pyrazolyl]-oxomethyl]amino]-3-hydroxypropanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[1-benzyl-3-(3,4-dimethylphenyl)pyrazole-4-carbonyl]amino]-3-hydroxypropanoate Traditional Name: (2R)-2-[[1-benzyl-3-(3,4-dimethylphenyl)pyrazole-4-carbonyl]amino]-3-hydroxy-propionic acid methyl ester Formula: C23H25N3O4 MolecularWeight: 407.4623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN(C=C2C(=O)NC(CO)C(=O)OC)CC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN(C=C2C(=O)N[C@H](CO)C(=O)OC)CC3=CC=CC=C3)C

InChI

InChI=1S/C23H25N3O4/c1-15-9-10-18(11-16(15)2)21-19(22(28)24-20(14-27)23(29)30-3)13-26(25-21)12-17-7-5-4-6-8-17/h4-11,13,20,27H,12,14H2,1-3H3,(H,24,28)/t20-/m1/s1