[(9S,10S)-10-acetyloxy-6-methyl-1,2,9,10-tetrahydrobenzo[j]aceanthrylen-9-yl] ethanoate

Systemtic Name: [(9S,10S)-10-acetyloxy-6-methyl-1,2,9,10-tetrahydrobenzo[j]aceanthrylen-9-yl] ethanoate Openeye Name: [(9S,10S)-10-acetoxy-6-methyl-1,2,9,10-tetrahydrobenzo[j]aceanthrylen-9-yl] acetate CAS Name: acetic acid [(9S,10S)-10-acetyloxy-6-methyl-1,2,9,10-tetrahydrobenzo[j]aceanthrylen-9-yl] ester IUPAC Name: [(9S,10S)-10-acetyloxy-6-methyl-1,2,9,10-tetrahydrobenzo[j]aceanthrylen-9-yl] acetate Traditional Name: acetic acid [(9S,10S)-10-acetoxy-6-methyl-1,2,9,10-tetrahydrobenz[j]aceanthrylen-9-yl] ester Formula: C25H22O4 MolecularWeight: 386.43978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=CC=C3C2=C(CC3)C4=C1C5=C(C=C4)C(C(C=C5)OC(=O)C)OC(=O)C

Isomeric SMILES

CC1=C2C=CC=C3C2=C(CC3)C4=C1C5=C(C=C4)[C@@H]([C@H](C=C5)OC(=O)C)OC(=O)C

InChI

InChI=1S/C25H22O4/c1-13-17-6-4-5-16-7-8-19(24(16)17)18-9-10-21-20(23(13)18)11-12-22(28-14(2)26)25(21)29-15(3)27/h4-6,9-12,22,25H,7-8H2,1-3H3/t22-,25-/m0/s1