methyl 4-[[(2S)-2-[(4-ethoxyphenyl)carbonylamino]-3-methyl-butanoyl]amino]benzoate

Systemtic Name: methyl 4-[[(2S)-2-[(4-ethoxyphenyl)carbonylamino]-3-methyl-butanoyl]amino]benzoate Openeye Name: methyl 4-[[(2S)-2-[(4-ethoxybenzoyl)amino]-3-methyl-butanoyl]amino]benzoate CAS Name: 4-[[(2S)-2-[[(4-ethoxyphenyl)-oxomethyl]amino]-3-methyl-1-oxobutyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[(2S)-2-[(4-ethoxybenzoyl)amino]-3-methylbutanoyl]amino]benzoate Traditional Name: 4-[[(2S)-2-[(4-ethoxybenzoyl)amino]-3-methyl-butanoyl]amino]benzoic acid methyl ester Formula: C22H26N2O5 MolecularWeight: 398.45224

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)NC(C(C)C)C(=O)NC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)N[C@@H](C(C)C)C(=O)NC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C22H26N2O5/c1-5-29-18-12-8-15(9-13-18)20(25)24-19(14(2)3)21(26)23-17-10-6-16(7-11-17)22(27)28-4/h6-14,19H,5H2,1-4H3,(H,23,26)(H,24,25)/t19-/m0/s1