1,2,9a-trimethoxy-9-phenyl-1,4a,4b,8a-tetrahydropyrido[3,4-b]indole; iodanylmethane

Systemtic Name: 1,2,9a-trimethoxy-9-phenyl-1,4a,4b,8a-tetrahydropyrido[3,4-b]indole; iodanylmethane Openeye Name: 1,2,9a-trimethoxy-9-phenyl-1,4a,4b,8a-tetrahydropyrido[3,4-b]indole; iodomethane CAS Name: 1,2,9a-trimethoxy-9-phenyl-1,4a,4b,8a-tetrahydropyrido[3,4-b]indole; iodomethane IUPAC Name: 1,2,9a-trimethoxy-9-phenyl-1,4a,4b,8a-tetrahydropyrido[3,4-b]indole; iodomethane Traditional Name: 1,2,9a-trimethoxy-9-phenyl-1,4a,4b,8a-tetrahydro-$b-carboline; iodomethane Formula: C21H27IN2O3 MolecularWeight: 482.35515

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Descriptors Computed from Structure

Canonical SMILES:

COC1C2(C(C=CN1OC)C3C=CC=CC3N2C4=CC=CC=C4)OC.CI

Isomeric SMILES

COC1C2(C(C=CN1OC)C3C=CC=CC3N2C4=CC=CC=C4)OC.CI

InChI

InChI=1S/C20H24N2O3.CH3I/c1-23-19-20(24-2)17(13-14-21(19)25-3)16-11-7-8-12-18(16)22(20)15-9-5-4-6-10-15;1-2/h4-14,16-19H,1-3H3;1H3