(1S,5S)-5,7-bis(diphenylmethyl)-1-methoxy-3-naphthalen-2-yl-bicyclo[3.2.1]octa-2,6-diene-4,8-dione

Systemtic Name: (1S,5S)-5,7-bis(diphenylmethyl)-1-methoxy-3-naphthalen-2-yl-bicyclo[3.2.1]octa-2,6-diene-4,8-dione Openeye Name: (1S,5S)-5,7-dibenzhydryl-1-methoxy-3-(2-naphthyl)bicyclo[3.2.1]octa-2,6-diene-4,8-dione CAS Name: (1S,5S)-5,7-bis(diphenylmethyl)-1-methoxy-3-(2-naphthalenyl)bicyclo[3.2.1]octa-2,6-diene-4,8-dione IUPAC Name: (1S,5S)-5,7-dibenzhydryl-1-methoxy-3-naphthalen-2-ylbicyclo[3.2.1]octa-2,6-diene-4,8-dione Traditional Name: (1S,5S)-5,7-dibenzhydryl-1-methoxy-3-(2-naphthyl)bicyclo[3.2.1]octa-2,6-diene-4,8-quinone Formula: C45H34O3 MolecularWeight: 622.74966

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Descriptors Computed from Structure

Canonical SMILES:

COC12C=C(C(=O)C(C1=O)(C=C2C(C3=CC=CC=C3)C4=CC=CC=C4)C(C5=CC=CC=C5)C6=CC=CC=C6)C7=CC8=CC=CC=C8C=C7

Isomeric SMILES

CO[C@]12C=C(C(=O)[C@](C1=O)(C=C2C(C3=CC=CC=C3)C4=CC=CC=C4)C(C5=CC=CC=C5)C6=CC=CC=C6)C7=CC8=CC=CC=C8C=C7

InChI

InChI=1S/C45H34O3/c1-48-45-29-38(37-27-26-31-16-14-15-25-36(31)28-37)42(46)44(43(45)47,41(34-21-10-4-11-22-34)35-23-12-5-13-24-35)30-39(45)40(32-17-6-2-7-18-32)33-19-8-3-9-20-33/h2-30,40-41H,1H3/t44-,45-/m0/s1