4-[2-(5-bromanyl-2-chloranyl-phenyl)-1H-benzo[g]indol-3-yl]butan-1-amine

Systemtic Name: 4-[2-(5-bromanyl-2-chloranyl-phenyl)-1H-benzo[g]indol-3-yl]butan-1-amine Openeye Name: 4-[2-(5-bromo-2-chloro-phenyl)-1H-benzo[g]indol-3-yl]butan-1-amine CAS Name: 4-[2-(5-bromo-2-chlorophenyl)-1H-benzo[g]indol-3-yl]-1-butanamine IUPAC Name: 4-[2-(5-bromo-2-chlorophenyl)-1H-benzo[g]indol-3-yl]butan-1-amine Traditional Name: 4-[2-(5-bromo-2-chloro-phenyl)-1H-benz[g]indol-3-yl]butylamine Formula: C22H20BrClN2 MolecularWeight: 427.7646

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC3=C2NC(=C3CCCCN)C4=C(C=CC(=C4)Br)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=CC3=C2NC(=C3CCCCN)C4=C(C=CC(=C4)Br)Cl

InChI

InChI=1S/C22H20BrClN2/c23-15-9-11-20(24)19(13-15)22-17(7-3-4-12-25)18-10-8-14-5-1-2-6-16(14)21(18)26-22/h1-2,5-6,8-11,13,26H,3-4,7,12,25H2