methyl 4-[[(2S)-2-[(4-tert-butylphenyl)carbonylamino]-3-methyl-butanoyl]oxymethyl]benzoate

Systemtic Name: methyl 4-[[(2S)-2-[(4-tert-butylphenyl)carbonylamino]-3-methyl-butanoyl]oxymethyl]benzoate Openeye Name: methyl 4-[[(2S)-2-[(4-tert-butylbenzoyl)amino]-3-methyl-butanoyl]oxymethyl]benzoate CAS Name: 4-[[(2S)-2-[[(4-tert-butylphenyl)-oxomethyl]amino]-3-methyl-1-oxobutoxy]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(2S)-2-[(4-tert-butylbenzoyl)amino]-3-methylbutanoyl]oxymethyl]benzoate Traditional Name: 4-[[(2S)-2-[(4-tert-butylbenzoyl)amino]-3-methyl-butanoyl]oxymethyl]benzoic acid methyl ester Formula: C25H31NO5 MolecularWeight: 425.51734

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC1=CC=C(C=C1)C(=O)OC)NC(=O)C2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CC(C)[C@@H](C(=O)OCC1=CC=C(C=C1)C(=O)OC)NC(=O)C2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C25H31NO5/c1-16(2)21(26-22(27)18-11-13-20(14-12-18)25(3,4)5)24(29)31-15-17-7-9-19(10-8-17)23(28)30-6/h7-14,16,21H,15H2,1-6H3,(H,26,27)/t21-/m0/s1