(4-pyrazol-1-ylphenyl)methyl (2S)-2-[(3,5-dimethoxyphenyl)carbonylamino]-3-methyl-butanoate

Systemtic Name: (4-pyrazol-1-ylphenyl)methyl (2S)-2-[(3,5-dimethoxyphenyl)carbonylamino]-3-methyl-butanoate Openeye Name: (4-pyrazol-1-ylphenyl)methyl (2S)-2-[(3,5-dimethoxybenzoyl)amino]-3-methyl-butanoate CAS Name: (2S)-2-[[(3,5-dimethoxyphenyl)-oxomethyl]amino]-3-methylbutanoic acid [4-(1-pyrazolyl)phenyl]methyl ester IUPAC Name: (4-pyrazol-1-ylphenyl)methyl (2S)-2-[(3,5-dimethoxybenzoyl)amino]-3-methylbutanoate Traditional Name: (2S)-2-[(3,5-dimethoxybenzoyl)amino]-3-methyl-butyric acid (4-pyrazol-1-ylbenzyl) ester Formula: C24H27N3O5 MolecularWeight: 437.48828

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC1=CC=C(C=C1)N2C=CC=N2)NC(=O)C3=CC(=CC(=C3)OC)OC

Isomeric SMILES

CC(C)[C@@H](C(=O)OCC1=CC=C(C=C1)N2C=CC=N2)NC(=O)C3=CC(=CC(=C3)OC)OC

InChI

InChI=1S/C24H27N3O5/c1-16(2)22(26-23(28)18-12-20(30-3)14-21(13-18)31-4)24(29)32-15-17-6-8-19(9-7-17)27-11-5-10-25-27/h5-14,16,22H,15H2,1-4H3,(H,26,28)/t22-/m0/s1