2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[4-oxidanylidene-2-(phenoxycarbonylamino)cyclopentyl]sulfanyl-propanoic acid

Systemtic Name: 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[4-oxidanylidene-2-(phenoxycarbonylamino)cyclopentyl]sulfanyl-propanoic acid Openeye Name: 2-(tert-butoxycarbonylamino)-3-[4-oxo-2-(phenoxycarbonylamino)cyclopentyl]sulfanyl-propanoic acid CAS Name: 2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-[[4-oxo-2-[[oxo(phenoxy)methyl]amino]cyclopentyl]thio]propanoic acid IUPAC Name: 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[4-oxo-2-(phenoxycarbonylamino)cyclopentyl]sulfanylpropanoic acid Traditional Name: 2-(tert-butoxycarbonylamino)-3-[[2-(carbophenoxyamino)-4-keto-cyclopentyl]thio]propionic acid Formula: C20H26N2O7S MolecularWeight: 438.49464

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CSC1CC(=O)CC1NC(=O)OC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NC(CSC1CC(=O)CC1NC(=O)OC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C20H26N2O7S/c1-20(2,3)29-19(27)22-15(17(24)25)11-30-16-10-12(23)9-14(16)21-18(26)28-13-7-5-4-6-8-13/h4-8,14-16H,9-11H2,1-3H3,(H,21,26)(H,22,27)(H,24,25)