(3aS,7aS)-2-(1-adamantylmethyl)-5-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione

Systemtic Name: (3aS,7aS)-2-(1-adamantylmethyl)-5-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione Openeye Name: (3aS,7aS)-2-(1-adamantylmethyl)-5-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione CAS Name: (3aS,7aS)-2-(1-adamantylmethyl)-5-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione IUPAC Name: (3aS,7aS)-2-(1-adamantylmethyl)-5-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione Traditional Name: (3aS,7aS)-2-(1-adamantylmethyl)-5-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-quinone Formula: C20H27NO2 MolecularWeight: 313.43388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC2C(C1)C(=O)N(C2=O)CC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=CC[C@H]2[C@H](C1)C(=O)N(C2=O)CC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C20H27NO2/c1-12-2-3-16-17(4-12)19(23)21(18(16)22)11-20-8-13-5-14(9-20)7-15(6-13)10-20/h2,13-17H,3-11H2,1H3/t13?,14?,15?,16-,17-,20?/m0/s1