4-(methoxymethyl)-9-(4-methylphenyl)sulfonyl-6-phenoxy-pyrido[3,4-b]indole-3-carbaldehyde

Systemtic Name: 4-(methoxymethyl)-9-(4-methylphenyl)sulfonyl-6-phenoxy-pyrido[3,4-b]indole-3-carbaldehyde Openeye Name: 4-(methoxymethyl)-6-phenoxy-9-(p-tolylsulfonyl)pyrido[3,4-b]indole-3-carbaldehyde CAS Name: 4-(methoxymethyl)-9-(4-methylphenyl)sulfonyl-6-phenoxy-3-pyrido[3,4-b]indolecarboxaldehyde IUPAC Name: 4-(methoxymethyl)-9-(4-methylphenyl)sulfonyl-6-phenoxypyrido[3,4-b]indole-3-carbaldehyde Traditional Name: 4-(methoxymethyl)-6-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=C(C=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=C(C=C3)OC4=CC=CC=C4)C5=C(C(=NC=C52)C=O)COC

InChI

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