2-[4-[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanylidene-3-phenylmethoxy-propyl]phenyl]cyclopropane-1-carboxylic acid

Systemtic Name: 2-[4-[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanylidene-3-phenylmethoxy-propyl]phenyl]cyclopropane-1-carboxylic acid Openeye Name: 2-[4-[(2S)-3-benzyloxy-2-(tert-butoxycarbonylamino)-3-oxo-propyl]phenyl]cyclopropanecarboxylic acid CAS Name: 2-[4-[(2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-oxo-3-phenylmethoxypropyl]phenyl]-1-cyclopropanecarboxylic acid IUPAC Name: 2-[4-[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxo-3-phenylmethoxypropyl]phenyl]cyclopropane-1-carboxylic acid Traditional Name: 2-[4-[(2S)-3-benzoxy-2-(tert-butoxycarbonylamino)-3-keto-propyl]phenyl]cyclopropanecarboxylic acid Formula: C25H29NO6 MolecularWeight: 439.50086

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=C(C=C1)C2CC2C(=O)O)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1=CC=C(C=C1)C2CC2C(=O)O)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C25H29NO6/c1-25(2,3)32-24(30)26-21(23(29)31-15-17-7-5-4-6-8-17)13-16-9-11-18(12-10-16)19-14-20(19)22(27)28/h4-12,19-21H,13-15H2,1-3H3,(H,26,30)(H,27,28)/t19?,20?,21-/m0/s1