methyl 4-spiro[5H-pyrrolo[1,2-a]quinoxaline-4,4'-piperidine]-1'-ylsulfonylbenzoate

Systemtic Name: methyl 4-spiro[5H-pyrrolo[1,2-a]quinoxaline-4,4'-piperidine]-1'-ylsulfonylbenzoate Openeye Name: methyl 4-spiro[5H-pyrrolo[1,2-a]quinoxaline-4,4'-piperidine]-1'-ylsulfonylbenzoate CAS Name: 4-(1'-spiro[5H-pyrrolo[1,2-a]quinoxaline-4,4'-piperidine]ylsulfonyl)benzoic acid methyl ester IUPAC Name: methyl 4-spiro[5H-pyrrolo[1,2-a]quinoxaline-4,4'-piperidine]-1'-ylsulfonylbenzoate Traditional Name: 4-spiro[5H-pyrrolo[1,2-a]quinoxaline-4,4'-piperidine]-1'-ylsulfonylbenzoic acid methyl ester Formula: C23H23N3O4S MolecularWeight: 437.51142

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC3(CC2)C4=CC=CN4C5=CC=CC=C5N3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC3(CC2)C4=CC=CN4C5=CC=CC=C5N3

InChI

InChI=1S/C23H23N3O4S/c1-30-22(27)17-8-10-18(11-9-17)31(28,29)25-15-12-23(13-16-25)21-7-4-14-26(21)20-6-3-2-5-19(20)24-23/h2-11,14,24H,12-13,15-16H2,1H3