(E,6S,7S)-7-(4-oxidanylnaphthalen-1-yl)-6-phenoxy-7-(phenylcarbonylcarbamoyloxy)hept-2-enoic acid

Systemtic Name: (E,6S,7S)-7-(4-oxidanylnaphthalen-1-yl)-6-phenoxy-7-(phenylcarbonylcarbamoyloxy)hept-2-enoic acid Openeye Name: (E,6S,7S)-7-(benzoylcarbamoyloxy)-7-(4-hydroxy-1-naphthyl)-6-phenoxy-hept-2-enoic acid CAS Name: (E,6S,7S)-7-[benzamido(oxo)methoxy]-7-(4-hydroxy-1-naphthalenyl)-6-phenoxy-2-heptenoic acid IUPAC Name: (E,6S,7S)-7-(benzoylcarbamoyloxy)-7-(4-hydroxynaphthalen-1-yl)-6-phenoxyhept-2-enoic acid Traditional Name: (E,6S,7S)-7-(benzoylcarbamoyloxy)-7-(4-hydroxy-1-naphthyl)-6-phenoxy-hept-2-enoic acid Formula: C31H27NO7 MolecularWeight: 525.54858

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC(=O)OC(C2=CC=C(C3=CC=CC=C32)O)C(CCC=CC(=O)O)OC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC(=O)O[C@@H](C2=CC=C(C3=CC=CC=C32)O)[C@H](CC/C=C/C(=O)O)OC4=CC=CC=C4

InChI

InChI=1S/C31H27NO7/c33-26-20-19-25(23-15-7-8-16-24(23)26)29(39-31(37)32-30(36)21-11-3-1-4-12-21)27(17-9-10-18-28(34)35)38-22-13-5-2-6-14-22/h1-8,10-16,18-20,27,29,33H,9,17H2,(H,34,35)(H,32,36,37)/b18-10+/t27-,29-/m0/s1