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

Systemtic Name: 3-ethenyl-4-(methoxymethyl)-9-(4-methylphenyl)sulfonyl-5-phenylmethoxy-pyrido[3,4-b]indole Openeye Name: 5-benzyloxy-4-(methoxymethyl)-9-(p-tolylsulfonyl)-3-vinyl-pyrido[3,4-b]indole CAS Name: 3-ethenyl-4-(methoxymethyl)-9-(4-methylphenyl)sulfonyl-5-phenylmethoxypyrido[3,4-b]indole IUPAC Name: 3-ethenyl-4-(methoxymethyl)-9-(4-methylphenyl)sulfonyl-5-phenylmethoxypyrido[3,4-b]indole Traditional Name: 5-benzoxy-4-(methoxymethyl)-9-tosyl-3-vinyl-$b-carboline Formula: C29H26N2O4S MolecularWeight: 498.59274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C3=C(C(=CC=C3)OCC4=CC=CC=C4)C5=C(C(=NC=C52)C=C)COC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C3=C(C(=CC=C3)OCC4=CC=CC=C4)C5=C(C(=NC=C52)C=C)COC

InChI

InChI=1S/C29H26N2O4S/c1-4-24-23(19-34-3)28-26(17-30-24)31(36(32,33)22-15-13-20(2)14-16-22)25-11-8-12-27(29(25)28)35-18-21-9-6-5-7-10-21/h4-17H,1,18-19H2,2-3H3