6-bromanyl-1-(4-methoxyphenyl)-2-pyrimidin-2-yl-1,3,4,9-tetrahydropyrido[3,4-b]indole

Systemtic Name: 6-bromanyl-1-(4-methoxyphenyl)-2-pyrimidin-2-yl-1,3,4,9-tetrahydropyrido[3,4-b]indole Openeye Name: 6-bromo-1-(4-methoxyphenyl)-2-pyrimidin-2-yl-1,3,4,9-tetrahydropyrido[3,4-b]indole CAS Name: 6-bromo-1-(4-methoxyphenyl)-2-(2-pyrimidinyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole IUPAC Name: 6-bromo-1-(4-methoxyphenyl)-2-pyrimidin-2-yl-1,3,4,9-tetrahydropyrido[3,4-b]indole Traditional Name: 6-bromo-1-(4-methoxyphenyl)-2-(2-pyrimidyl)-1,3,4,9-tetrahydro-$b-carboline Formula: C22H19BrN4O MolecularWeight: 435.31646

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2C3=C(CCN2C4=NC=CC=N4)C5=C(N3)C=CC(=C5)Br

Isomeric SMILES

COC1=CC=C(C=C1)C2C3=C(CCN2C4=NC=CC=N4)C5=C(N3)C=CC(=C5)Br

InChI

InChI=1S/C22H19BrN4O/c1-28-16-6-3-14(4-7-16)21-20-17(18-13-15(23)5-8-19(18)26-20)9-12-27(21)22-24-10-2-11-25-22/h2-8,10-11,13,21,26H,9,12H2,1H3