1-[5-fluoranyl-3-(4-methoxyphenyl)carbonyl-1-(sulfamoylamino)cyclohexa-2,4-dien-1-yl]-3H-pyrrolizine

Systemtic Name: 1-[5-fluoranyl-3-(4-methoxyphenyl)carbonyl-1-(sulfamoylamino)cyclohexa-2,4-dien-1-yl]-3H-pyrrolizine Openeye Name: 1-[5-fluoro-3-(4-methoxybenzoyl)-1-(sulfamoylamino)cyclohexa-2,4-dien-1-yl]-3H-pyrrolizine CAS Name: 1-[5-fluoro-3-[(4-methoxyphenyl)-oxomethyl]-1-(sulfamoylamino)-1-cyclohexa-2,4-dienyl]-3H-pyrrolizine IUPAC Name: 1-[5-fluoro-3-(4-methoxybenzoyl)-1-(sulfamoylamino)cyclohexa-2,4-dien-1-yl]-3H-pyrrolizine Traditional Name: 1-[5-fluoro-3-p-anisoyl-1-(sulfamoylamino)cyclohexa-2,4-dien-1-yl]-3H-pyrrolizine Formula: C21H20FN3O4S MolecularWeight: 429.464603

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)C2=CC(CC(=C2)F)(C3=CCN4C3=CC=C4)NS(=O)(=O)N

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)C2=CC(CC(=C2)F)(C3=CCN4C3=CC=C4)NS(=O)(=O)N

InChI

InChI=1S/C21H20FN3O4S/c1-29-17-6-4-14(5-7-17)20(26)15-11-16(22)13-21(12-15,24-30(23,27)28)18-8-10-25-9-2-3-19(18)25/h2-9,11-12,24H,10,13H2,1H3,(H2,23,27,28)