methyl 3-(4-ethylphenyl)-3-[[(2S)-3-methyl-2-(phenoxycarbonylamino)butanoyl]amino]propanoate

Systemtic Name: methyl 3-(4-ethylphenyl)-3-[[(2S)-3-methyl-2-(phenoxycarbonylamino)butanoyl]amino]propanoate Openeye Name: methyl 3-(4-ethylphenyl)-3-[[(2S)-3-methyl-2-(phenoxycarbonylamino)butanoyl]amino]propanoate CAS Name: 3-(4-ethylphenyl)-3-[[(2S)-3-methyl-1-oxo-2-[[oxo(phenoxy)methyl]amino]butyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-(4-ethylphenyl)-3-[[(2S)-3-methyl-2-(phenoxycarbonylamino)butanoyl]amino]propanoate Traditional Name: 3-[[(2S)-2-(carbophenoxyamino)-3-methyl-butanoyl]amino]-3-(4-ethylphenyl)propionic acid methyl ester Formula: C24H30N2O5 MolecularWeight: 426.5054

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(CC(=O)OC)NC(=O)C(C(C)C)NC(=O)OC2=CC=CC=C2

Isomeric SMILES

CCC1=CC=C(C=C1)C(CC(=O)OC)NC(=O)[C@H](C(C)C)NC(=O)OC2=CC=CC=C2

InChI

InChI=1S/C24H30N2O5/c1-5-17-11-13-18(14-12-17)20(15-21(27)30-4)25-23(28)22(16(2)3)26-24(29)31-19-9-7-6-8-10-19/h6-14,16,20,22H,5,15H2,1-4H3,(H,25,28)(H,26,29)/t20?,22-/m0/s1