4-(methoxymethyl)-9-(4-methylphenyl)sulfonyl-5-phenoxy-pyrido[3,4-b]indole-3-carbaldehyde

Systemtic Name: 4-(methoxymethyl)-9-(4-methylphenyl)sulfonyl-5-phenoxy-pyrido[3,4-b]indole-3-carbaldehyde Openeye Name: 4-(methoxymethyl)-5-phenoxy-9-(p-tolylsulfonyl)pyrido[3,4-b]indole-3-carbaldehyde CAS Name: 4-(methoxymethyl)-9-(4-methylphenyl)sulfonyl-5-phenoxy-3-pyrido[3,4-b]indolecarboxaldehyde IUPAC Name: 4-(methoxymethyl)-9-(4-methylphenyl)sulfonyl-5-phenoxypyrido[3,4-b]indole-3-carbaldehyde Traditional Name: 4-(methoxymethyl)-5-phenoxy-9-tosyl-$b-carboline-3-carbaldehyde Formula: C27H22N2O5S MolecularWeight: 486.53898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C3=C(C(=CC=C3)OC4=CC=CC=C4)C5=C(C(=NC=C52)C=O)COC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C3=C(C(=CC=C3)OC4=CC=CC=C4)C5=C(C(=NC=C52)C=O)COC

InChI

InChI=1S/C27H22N2O5S/c1-18-11-13-20(14-12-18)35(31,32)29-23-9-6-10-25(34-19-7-4-3-5-8-19)27(23)26-21(17-33-2)22(16-30)28-15-24(26)29/h3-16H,17H2,1-2H3