1-oxidanylidene-2-phenyl-9-(phenylmethyl)-3,4-dihydropyrido[3,4-b]indole-6-sulfonic acid

Systemtic Name: 1-oxidanylidene-2-phenyl-9-(phenylmethyl)-3,4-dihydropyrido[3,4-b]indole-6-sulfonic acid Openeye Name: 9-benzyl-1-oxo-2-phenyl-3,4-dihydropyrido[3,4-b]indole-6-sulfonic acid CAS Name: 1-oxo-2-phenyl-9-(phenylmethyl)-3,4-dihydropyrido[3,4-b]indole-6-sulfonic acid IUPAC Name: 9-benzyl-1-oxo-2-phenyl-3,4-dihydropyrido[3,4-b]indole-6-sulfonic acid Traditional Name: 9-benzyl-1-keto-2-phenyl-3,4-dihydro-$b-carboline-6-sulfonic acid Formula: C24H20N2O4S MolecularWeight: 432.4916

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C2=C1C3=C(N2CC4=CC=CC=C4)C=CC(=C3)S(=O)(=O)O)C5=CC=CC=C5

Isomeric SMILES

C1CN(C(=O)C2=C1C3=C(N2CC4=CC=CC=C4)C=CC(=C3)S(=O)(=O)O)C5=CC=CC=C5

InChI

InChI=1S/C24H20N2O4S/c27-24-23-20(13-14-25(24)18-9-5-2-6-10-18)21-15-19(31(28,29)30)11-12-22(21)26(23)16-17-7-3-1-4-8-17/h1-12,15H,13-14,16H2,(H,28,29,30)