3-[1-[2,5-dimethyl-1-(phenylmethyl)pyrrol-3-yl]but-3-enyl]-1H-indole

Systemtic Name: 3-[1-[2,5-dimethyl-1-(phenylmethyl)pyrrol-3-yl]but-3-enyl]-1H-indole Openeye Name: 3-[1-(1-benzyl-2,5-dimethyl-pyrrol-3-yl)but-3-enyl]-1H-indole CAS Name: 3-[1-[2,5-dimethyl-1-(phenylmethyl)-3-pyrrolyl]but-3-enyl]-1H-indole IUPAC Name: 3-[1-(1-benzyl-2,5-dimethylpyrrol-3-yl)but-3-enyl]-1H-indole Traditional Name: 3-[1-(1-benzyl-2,5-dimethyl-pyrrol-3-yl)but-3-enyl]-1H-indole Formula: C25H26N2 MolecularWeight: 354.48734

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC2=CC=CC=C2)C)C(CC=C)C3=CNC4=CC=CC=C43

Isomeric SMILES

CC1=CC(=C(N1CC2=CC=CC=C2)C)C(CC=C)C3=CNC4=CC=CC=C43

InChI

InChI=1S/C25H26N2/c1-4-10-21(24-16-26-25-14-9-8-13-22(24)25)23-15-18(2)27(19(23)3)17-20-11-6-5-7-12-20/h4-9,11-16,21,26H,1,10,17H2,2-3H3