9-(1-bromanyl-3-phenyl-propyl)-2-(phenylmethyl)-4b,8a-dihydro-4aH-pyrido[3,4-b]indole

Systemtic Name: 9-(1-bromanyl-3-phenyl-propyl)-2-(phenylmethyl)-4b,8a-dihydro-4aH-pyrido[3,4-b]indole Openeye Name: 2-benzyl-9-(1-bromo-3-phenyl-propyl)-4b,8a-dihydro-4aH-pyrido[3,4-b]indole CAS Name: 9-(1-bromo-3-phenylpropyl)-2-(phenylmethyl)-4b,8a-dihydro-4aH-pyrido[3,4-b]indole IUPAC Name: 2-benzyl-9-(1-bromo-3-phenylpropyl)-4b,8a-dihydro-4aH-pyrido[3,4-b]indole Traditional Name: 2-benzyl-9-(1-bromo-3-phenyl-propyl)-4b,8a-dihydro-4aH-$b-carboline Formula: C27H27BrN2 MolecularWeight: 459.42068

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(N2C3C=CC=CC3C4C2=CN(C=C4)CC5=CC=CC=C5)Br

Isomeric SMILES

C1=CC=C(C=C1)CCC(N2C3C=CC=CC3C4C2=CN(C=C4)CC5=CC=CC=C5)Br

InChI

InChI=1S/C27H27BrN2/c28-27(16-15-21-9-3-1-4-10-21)30-25-14-8-7-13-23(25)24-17-18-29(20-26(24)30)19-22-11-5-2-6-12-22/h1-14,17-18,20,23-25,27H,15-16,19H2