5-(2-phenethylpyrrolidin-1-yl)sulfonyl-1H-indole-2,3-dione

Systemtic Name: 5-(2-phenethylpyrrolidin-1-yl)sulfonyl-1H-indole-2,3-dione Openeye Name: 5-(2-phenethylpyrrolidin-1-yl)sulfonylindoline-2,3-dione CAS Name: 5-[(2-phenethyl-1-pyrrolidinyl)sulfonyl]-1H-indole-2,3-dione IUPAC Name: 5-(2-phenethylpyrrolidin-1-yl)sulfonyl-1H-indole-2,3-dione Traditional Name: 5-(2-phenethylpyrrolidino)sulfonylisatin Formula: C20H20N2O4S MolecularWeight: 384.4488

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC3=C(C=C2)NC(=O)C3=O)CCC4=CC=CC=C4

Isomeric SMILES

C1CC(N(C1)S(=O)(=O)C2=CC3=C(C=C2)NC(=O)C3=O)CCC4=CC=CC=C4

InChI

InChI=1S/C20H20N2O4S/c23-19-17-13-16(10-11-18(17)21-20(19)24)27(25,26)22-12-4-7-15(22)9-8-14-5-2-1-3-6-14/h1-3,5-6,10-11,13,15H,4,7-9,12H2,(H,21,23,24)