ethyl (E)-3-[1-(2,6-dimethylheptan-4-yl)indol-5-yl]but-2-enoate

Systemtic Name: ethyl (E)-3-[1-(2,6-dimethylheptan-4-yl)indol-5-yl]but-2-enoate Openeye Name: ethyl (E)-3-[1-(1-isobutyl-3-methyl-butyl)indol-5-yl]but-2-enoate CAS Name: (E)-3-[1-(2,6-dimethylheptan-4-yl)-5-indolyl]-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[1-(2,6-dimethylheptan-4-yl)indol-5-yl]but-2-enoate Traditional Name: (E)-3-[1-(1-isobutyl-3-methyl-butyl)indol-5-yl]but-2-enoic acid ethyl ester Formula: C23H33NO2 MolecularWeight: 355.51362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=C(C)C1=CC2=C(C=C1)N(C=C2)C(CC(C)C)CC(C)C

Isomeric SMILES

CCOC(=O)/C=C(\C)/C1=CC2=C(C=C1)N(C=C2)C(CC(C)C)CC(C)C

InChI

InChI=1S/C23H33NO2/c1-7-26-23(25)14-18(6)19-8-9-22-20(15-19)10-11-24(22)21(12-16(2)3)13-17(4)5/h8-11,14-17,21H,7,12-13H2,1-6H3/b18-14+