methyl (2S)-2-[[3-(2-chlorophenyl)-1H-pyrazol-5-yl]carbonylamino]-3-phenyl-propanoate

Systemtic Name: methyl (2S)-2-[[3-(2-chlorophenyl)-1H-pyrazol-5-yl]carbonylamino]-3-phenyl-propanoate Openeye Name: methyl (2S)-2-[[3-(2-chlorophenyl)-1H-pyrazole-5-carbonyl]amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[[3-(2-chlorophenyl)-1H-pyrazol-5-yl]-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[3-(2-chlorophenyl)-1H-pyrazole-5-carbonyl]amino]-3-phenylpropanoate Traditional Name: (2S)-2-[[3-(2-chlorophenyl)-1H-pyrazole-5-carbonyl]amino]-3-phenyl-propionic acid methyl ester Formula: C20H18ClN3O3 MolecularWeight: 383.82822

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NC(=O)C2=CC(=NN2)C3=CC=CC=C3Cl

Isomeric SMILES

COC(=O)[C@H](CC1=CC=CC=C1)NC(=O)C2=CC(=NN2)C3=CC=CC=C3Cl

InChI

InChI=1S/C20H18ClN3O3/c1-27-20(26)18(11-13-7-3-2-4-8-13)22-19(25)17-12-16(23-24-17)14-9-5-6-10-15(14)21/h2-10,12,18H,11H2,1H3,(H,22,25)(H,23,24)/t18-/m0/s1