4-[[4-(3-methoxyprop-1-ynyl)phenyl]carbonylamino]-5-oxidanyl-2-(phenylmethyl)pentanoic acid

Systemtic Name: 4-[[4-(3-methoxyprop-1-ynyl)phenyl]carbonylamino]-5-oxidanyl-2-(phenylmethyl)pentanoic acid Openeye Name: 2-benzyl-5-hydroxy-4-[[4-(3-methoxyprop-1-ynyl)benzoyl]amino]pentanoic acid CAS Name: 5-hydroxy-4-[[[4-(3-methoxyprop-1-ynyl)phenyl]-oxomethyl]amino]-2-(phenylmethyl)pentanoic acid IUPAC Name: 2-benzyl-5-hydroxy-4-[[4-(3-methoxyprop-1-ynyl)benzoyl]amino]pentanoic acid Traditional Name: 2-benzyl-5-hydroxy-4-[[4-(3-methoxyprop-1-ynyl)benzoyl]amino]valeric acid Formula: C23H25NO5 MolecularWeight: 395.4483

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Descriptors Computed from Structure

Canonical SMILES:

COCC#CC1=CC=C(C=C1)C(=O)NC(CC(CC2=CC=CC=C2)C(=O)O)CO

Isomeric SMILES

COCC#CC1=CC=C(C=C1)C(=O)NC(CC(CC2=CC=CC=C2)C(=O)O)CO

InChI

InChI=1S/C23H25NO5/c1-29-13-5-8-17-9-11-19(12-10-17)22(26)24-21(16-25)15-20(23(27)28)14-18-6-3-2-4-7-18/h2-4,6-7,9-12,20-21,25H,13-16H2,1H3,(H,24,26)(H,27,28)