(E,6S,7S)-6-methyl-7-(naphthalen-1-ylcarbamoyloxy)-7-(4-oxidanylnaphthalen-1-yl)hept-2-enoic acid

Systemtic Name: (E,6S,7S)-6-methyl-7-(naphthalen-1-ylcarbamoyloxy)-7-(4-oxidanylnaphthalen-1-yl)hept-2-enoic acid Openeye Name: (E,6S,7S)-7-(4-hydroxy-1-naphthyl)-6-methyl-7-(1-naphthylcarbamoyloxy)hept-2-enoic acid CAS Name: (E,6S,7S)-7-(4-hydroxy-1-naphthalenyl)-6-methyl-7-[(1-naphthalenylamino)-oxomethoxy]-2-heptenoic acid IUPAC Name: (E,6S,7S)-7-(4-hydroxynaphthalen-1-yl)-6-methyl-7-(naphthalen-1-ylcarbamoyloxy)hept-2-enoic acid Traditional Name: (E,6S,7S)-7-(4-hydroxy-1-naphthyl)-6-methyl-7-(1-naphthylcarbamoyloxy)hept-2-enoic acid Formula: C29H27NO5 MolecularWeight: 469.52838

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC=CC(=O)O)C(C1=CC=C(C2=CC=CC=C21)O)OC(=O)NC3=CC=CC4=CC=CC=C43

Isomeric SMILES

C[C@@H](CC/C=C/C(=O)O)[C@@H](C1=CC=C(C2=CC=CC=C21)O)OC(=O)NC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C29H27NO5/c1-19(9-2-7-16-27(32)33)28(24-17-18-26(31)23-14-6-5-13-22(23)24)35-29(34)30-25-15-8-11-20-10-3-4-12-21(20)25/h3-8,10-19,28,31H,2,9H2,1H3,(H,30,34)(H,32,33)/b16-7+/t19-,28-/m0/s1