2-[2,3-bis(bromanyl)-4-[(2-butyl-4-chloranyl-5-methanoyl-indol-1-yl)methyl]indol-1-yl]benzenecarbonitrile

Systemtic Name: 2-[2,3-bis(bromanyl)-4-[(2-butyl-4-chloranyl-5-methanoyl-indol-1-yl)methyl]indol-1-yl]benzenecarbonitrile Openeye Name: 2-[2,3-dibromo-4-[(2-butyl-4-chloro-5-formyl-indol-1-yl)methyl]indol-1-yl]benzonitrile CAS Name: 2-[2,3-dibromo-4-[(2-butyl-4-chloro-5-formyl-1-indolyl)methyl]-1-indolyl]benzonitrile IUPAC Name: 2-[2,3-dibromo-4-[(2-butyl-4-chloro-5-formylindol-1-yl)methyl]indol-1-yl]benzonitrile Traditional Name: 2-[2,3-dibromo-4-[(2-butyl-4-chloro-5-formyl-indol-1-yl)methyl]indol-1-yl]benzonitrile Formula: C29H22Br2ClN3O MolecularWeight: 623.76548

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(N1CC3=C4C(=CC=C3)N(C(=C4Br)Br)C5=CC=CC=C5C#N)C=CC(=C2Cl)C=O

Isomeric SMILES

CCCCC1=CC2=C(N1CC3=C4C(=CC=C3)N(C(=C4Br)Br)C5=CC=CC=C5C#N)C=CC(=C2Cl)C=O

InChI

InChI=1S/C29H22Br2ClN3O/c1-2-3-9-21-14-22-24(13-12-20(17-36)28(22)32)34(21)16-19-8-6-11-25-26(19)27(30)29(31)35(25)23-10-5-4-7-18(23)15-33/h4-8,10-14,17H,2-3,9,16H2,1H3