2-bromanyl-1-[(2-hex-1-ynylphenyl)methyl]indole-3-carbaldehyde

Systemtic Name: 2-bromanyl-1-[(2-hex-1-ynylphenyl)methyl]indole-3-carbaldehyde Openeye Name: 2-bromo-1-[(2-hex-1-ynylphenyl)methyl]indole-3-carbaldehyde CAS Name: 2-bromo-1-[(2-hex-1-ynylphenyl)methyl]-3-indolecarboxaldehyde IUPAC Name: 2-bromo-1-[(2-hex-1-ynylphenyl)methyl]indole-3-carbaldehyde Traditional Name: 2-bromo-1-(2-hex-1-ynylbenzyl)indole-3-carbaldehyde Formula: C22H20BrNO MolecularWeight: 394.3043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC1=CC=CC=C1CN2C3=CC=CC=C3C(=C2Br)C=O

Isomeric SMILES

CCCCC#CC1=CC=CC=C1CN2C3=CC=CC=C3C(=C2Br)C=O

InChI

InChI=1S/C22H20BrNO/c1-2-3-4-5-10-17-11-6-7-12-18(17)15-24-21-14-9-8-13-19(21)20(16-25)22(24)23/h6-9,11-14,16H,2-4,15H2,1H3