3-(4-pyrrolidin-1-ylsulfonylphenyl)-2H-phthalazine-1,4-dione

Systemtic Name: 3-(4-pyrrolidin-1-ylsulfonylphenyl)-2H-phthalazine-1,4-dione Openeye Name: 3-(4-pyrrolidin-1-ylsulfonylphenyl)-2H-phthalazine-1,4-dione CAS Name: 3-[4-(1-pyrrolidinylsulfonyl)phenyl]-2H-phthalazine-1,4-dione IUPAC Name: 3-(4-pyrrolidin-1-ylsulfonylphenyl)-2H-phthalazine-1,4-dione Traditional Name: 3-(4-pyrrolidinosulfonylphenyl)-2H-phthalazine-1,4-quinone Formula: C18H17N3O4S MolecularWeight: 371.41028

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)N3C(=O)C4=CC=CC=C4C(=O)N3

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)N3C(=O)C4=CC=CC=C4C(=O)N3

InChI

InChI=1S/C18H17N3O4S/c22-17-15-5-1-2-6-16(15)18(23)21(19-17)13-7-9-14(10-8-13)26(24,25)20-11-3-4-12-20/h1-2,5-10H,3-4,11-12H2,(H,19,22)