2-(5-bromanyl-2-methoxy-phenyl)sulfonyl-1-ethyl-1,3,4,9-tetrahydropyrido[3,4-b]indole

Systemtic Name: 2-(5-bromanyl-2-methoxy-phenyl)sulfonyl-1-ethyl-1,3,4,9-tetrahydropyrido[3,4-b]indole Openeye Name: 2-(5-bromo-2-methoxy-phenyl)sulfonyl-1-ethyl-1,3,4,9-tetrahydropyrido[3,4-b]indole CAS Name: 2-(5-bromo-2-methoxyphenyl)sulfonyl-1-ethyl-1,3,4,9-tetrahydropyrido[3,4-b]indole IUPAC Name: 2-(5-bromo-2-methoxyphenyl)sulfonyl-1-ethyl-1,3,4,9-tetrahydropyrido[3,4-b]indole Traditional Name: 2-(5-bromo-2-methoxy-phenyl)sulfonyl-1-ethyl-1,3,4,9-tetrahydro-$b-carboline Formula: C20H21BrN2O3S MolecularWeight: 449.36134

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C2=C(CCN1S(=O)(=O)C3=C(C=CC(=C3)Br)OC)C4=CC=CC=C4N2

Isomeric SMILES

CCC1C2=C(CCN1S(=O)(=O)C3=C(C=CC(=C3)Br)OC)C4=CC=CC=C4N2

InChI

InChI=1S/C20H21BrN2O3S/c1-3-17-20-15(14-6-4-5-7-16(14)22-20)10-11-23(17)27(24,25)19-12-13(21)8-9-18(19)26-2/h4-9,12,17,22H,3,10-11H2,1-2H3