(E,7R)-7-[(4-bromophenyl)carbamoyloxy]-7-(4-oxidanylnaphthalen-1-yl)hept-2-enoic acid

Systemtic Name: (E,7R)-7-[(4-bromophenyl)carbamoyloxy]-7-(4-oxidanylnaphthalen-1-yl)hept-2-enoic acid Openeye Name: (E,7R)-7-[(4-bromophenyl)carbamoyloxy]-7-(4-hydroxy-1-naphthyl)hept-2-enoic acid CAS Name: (E,7R)-7-[(4-bromoanilino)-oxomethoxy]-7-(4-hydroxy-1-naphthalenyl)-2-heptenoic acid IUPAC Name: (E,7R)-7-[(4-bromophenyl)carbamoyloxy]-7-(4-hydroxynaphthalen-1-yl)hept-2-enoic acid Traditional Name: (E,7R)-7-[(4-bromophenyl)carbamoyloxy]-7-(4-hydroxy-1-naphthyl)hept-2-enoic acid Formula: C24H22BrNO5 MolecularWeight: 484.33918

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC=C2O)C(CCCC=CC(=O)O)OC(=O)NC3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC=C2O)[C@@H](CCC/C=C/C(=O)O)OC(=O)NC3=CC=C(C=C3)Br

InChI

InChI=1S/C24H22BrNO5/c25-16-10-12-17(13-11-16)26-24(30)31-22(8-2-1-3-9-23(28)29)20-14-15-21(27)19-7-5-4-6-18(19)20/h3-7,9-15,22,27H,1-2,8H2,(H,26,30)(H,28,29)/b9-3+/t22-/m1/s1