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

Systemtic Name: (E,6S,7S)-6-methyl-7-(4-oxidanylnaphthalen-1-yl)-7-(phenylcarbamoyloxy)hept-2-enoic acid Openeye Name: (E,6S,7S)-7-(4-hydroxy-1-naphthyl)-6-methyl-7-(phenylcarbamoyloxy)hept-2-enoic acid CAS Name: (E,6S,7S)-7-[anilino(oxo)methoxy]-7-(4-hydroxy-1-naphthalenyl)-6-methyl-2-heptenoic acid IUPAC Name: (E,6S,7S)-7-(4-hydroxynaphthalen-1-yl)-6-methyl-7-(phenylcarbamoyloxy)hept-2-enoic acid Traditional Name: (E,6S,7S)-7-(4-hydroxy-1-naphthyl)-6-methyl-7-(phenylcarbamoyloxy)hept-2-enoic acid Formula: C25H25NO5 MolecularWeight: 419.4697

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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=CC=C3

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=CC=C3

InChI

InChI=1S/C25H25NO5/c1-17(9-5-8-14-23(28)29)24(31-25(30)26-18-10-3-2-4-11-18)21-15-16-22(27)20-13-7-6-12-19(20)21/h2-4,6-8,10-17,24,27H,5,9H2,1H3,(H,26,30)(H,28,29)/b14-8+/t17-,24-/m0/s1