4-methyl-8-morpholin-4-ylsulfonyl-2-[(3S,5R)-4-oxidanylidene-1-adamantyl]pyrrolo[3,4-c]quinoline-1,3-dione

Systemtic Name: 4-methyl-8-morpholin-4-ylsulfonyl-2-[(3S,5R)-4-oxidanylidene-1-adamantyl]pyrrolo[3,4-c]quinoline-1,3-dione Openeye Name: 4-methyl-8-morpholinosulfonyl-2-[(3S,5R)-4-oxo-1-adamantyl]pyrrolo[3,4-c]quinoline-1,3-dione CAS Name: 4-methyl-8-(4-morpholinylsulfonyl)-2-[(3S,5R)-4-oxo-1-adamantyl]pyrrolo[3,4-c]quinoline-1,3-dione IUPAC Name: 4-methyl-8-morpholin-4-ylsulfonyl-2-[(3S,5R)-4-oxo-1-adamantyl]pyrrolo[3,4-c]quinoline-1,3-dione Traditional Name: 2-[(3S,5R)-4-keto-1-adamantyl]-4-methyl-8-morpholinosulfonyl-pyrrolo[3,4-c]quinoline-1,3-quinone Formula: C26H27N3O6S MolecularWeight: 509.57408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C3C=C(C=CC3=N1)S(=O)(=O)N4CCOCC4)C(=O)N(C2=O)C56CC7CC(C5)C(=O)C(C7)C6

Isomeric SMILES

CC1=C2C(=C3C=C(C=CC3=N1)S(=O)(=O)N4CCOCC4)C(=O)N(C2=O)C56C[C@H]7CC(C5)C[C@@H](C6)C7=O

InChI

InChI=1S/C26H27N3O6S/c1-14-21-22(19-10-18(2-3-20(19)27-14)36(33,34)28-4-6-35-7-5-28)25(32)29(24(21)31)26-11-15-8-16(12-26)23(30)17(9-15)13-26/h2-3,10,15-17H,4-9,11-13H2,1H3/t15?,16-,17+,26?