butyl (2S)-2-[[(2S)-2-acetamidopropanoyl]amino]-3-(4-hydroxyphenyl)propanoate

Systemtic Name: butyl (2S)-2-[[(2S)-2-acetamidopropanoyl]amino]-3-(4-hydroxyphenyl)propanoate Openeye Name: butyl (2S)-2-[[(2S)-2-acetamidopropanoyl]amino]-3-(4-hydroxyphenyl)propanoate CAS Name: (2S)-2-[[(2S)-2-acetamido-1-oxopropyl]amino]-3-(4-hydroxyphenyl)propanoic acid butyl ester IUPAC Name: butyl (2S)-2-[[(2S)-2-acetamidopropanoyl]amino]-3-(4-hydroxyphenyl)propanoate Traditional Name: (2S)-2-[[(2S)-2-acetamidopropanoyl]amino]-3-(4-hydroxyphenyl)propionic acid butyl ester Formula: C18H26N2O5 MolecularWeight: 350.40944

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(CC1=CC=C(C=C1)O)NC(=O)C(C)NC(=O)C

Isomeric SMILES

CCCCOC(=O)[C@H](CC1=CC=C(C=C1)O)NC(=O)[C@H](C)NC(=O)C

InChI

InChI=1S/C18H26N2O5/c1-4-5-10-25-18(24)16(11-14-6-8-15(22)9-7-14)20-17(23)12(2)19-13(3)21/h6-9,12,16,22H,4-5,10-11H2,1-3H3,(H,19,21)(H,20,23)/t12-,16-/m0/s1