2-[[2-oxidanylidene-3-(phenylmethoxycarbonylamino)azetidin-1-yl]carbonyl-(3-phenylmethoxyphenyl)amino]ethanoic acid

Systemtic Name: 2-[[2-oxidanylidene-3-(phenylmethoxycarbonylamino)azetidin-1-yl]carbonyl-(3-phenylmethoxyphenyl)amino]ethanoic acid Openeye Name: 2-(3-benzyloxy-N-[3-(benzyloxycarbonylamino)-2-oxo-azetidine-1-carbonyl]anilino)acetic acid CAS Name: 2-(N-[oxo-[2-oxo-3-(phenylmethoxycarbonylamino)-1-azetidinyl]methyl]-3-phenylmethoxyanilino)acetic acid IUPAC Name: 2-(N-[2-oxo-3-(phenylmethoxycarbonylamino)azetidine-1-carbonyl]-3-phenylmethoxyanilino)acetic acid Traditional Name: 2-(3-benzoxy-N-[3-(benzyloxycarbonylamino)-2-keto-azetidine-1-carbonyl]anilino)acetic acid Formula: C27H25N3O7 MolecularWeight: 503.5033

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)N1C(=O)N(CC(=O)O)C2=CC(=CC=C2)OCC3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1C(C(=O)N1C(=O)N(CC(=O)O)C2=CC(=CC=C2)OCC3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C27H25N3O7/c31-24(32)16-29(21-12-7-13-22(14-21)36-17-19-8-3-1-4-9-19)27(35)30-15-23(25(30)33)28-26(34)37-18-20-10-5-2-6-11-20/h1-14,23H,15-18H2,(H,28,34)(H,31,32)