8-methyl-5-(4-piperidin-1-ylsulfonylphenyl)-1,6,7,9-tetrahydropyrrolo[3,2-h]isoquinoline-2,3-dione

Systemtic Name: 8-methyl-5-(4-piperidin-1-ylsulfonylphenyl)-1,6,7,9-tetrahydropyrrolo[3,2-h]isoquinoline-2,3-dione Openeye Name: 8-methyl-5-[4-(1-piperidylsulfonyl)phenyl]-1,6,7,9-tetrahydropyrrolo[3,2-h]isoquinoline-2,3-dione CAS Name: 8-methyl-5-[4-(1-piperidinylsulfonyl)phenyl]-1,6,7,9-tetrahydropyrrolo[3,2-h]isoquinoline-2,3-dione IUPAC Name: 8-methyl-5-(4-piperidin-1-ylsulfonylphenyl)-1,6,7,9-tetrahydropyrrolo[3,2-h]isoquinoline-2,3-dione Traditional Name: 8-methyl-5-(4-piperidinosulfonylphenyl)-1,6,7,9-tetrahydropyrrol[3,2-h]isoquinoline-2,3-quinone Formula: C23H25N3O4S MolecularWeight: 439.5273

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=C(C1)C3=C(C=C2C4=CC=C(C=C4)S(=O)(=O)N5CCCCC5)C(=O)C(=O)N3

Isomeric SMILES

CN1CCC2=C(C1)C3=C(C=C2C4=CC=C(C=C4)S(=O)(=O)N5CCCCC5)C(=O)C(=O)N3

InChI

InChI=1S/C23H25N3O4S/c1-25-12-9-17-18(13-19-21(20(17)14-25)24-23(28)22(19)27)15-5-7-16(8-6-15)31(29,30)26-10-3-2-4-11-26/h5-8,13H,2-4,9-12,14H2,1H3,(H,24,27,28)