ethyl (E)-3-[1-[(2-methylphenyl)methyl]indol-5-yl]but-2-enoate

Systemtic Name: ethyl (E)-3-[1-[(2-methylphenyl)methyl]indol-5-yl]but-2-enoate Openeye Name: ethyl (E)-3-[1-(o-tolylmethyl)indol-5-yl]but-2-enoate CAS Name: (E)-3-[1-[(2-methylphenyl)methyl]-5-indolyl]-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[1-[(2-methylphenyl)methyl]indol-5-yl]but-2-enoate Traditional Name: (E)-3-[1-(2-methylbenzyl)indol-5-yl]but-2-enoic acid ethyl ester Formula: C22H23NO2 MolecularWeight: 333.42352

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)CC3=CC=CC=C3C

Isomeric SMILES

CCOC(=O)/C=C(\C)/C1=CC2=C(C=C1)N(C=C2)CC3=CC=CC=C3C

InChI

InChI=1S/C22H23NO2/c1-4-25-22(24)13-17(3)18-9-10-21-19(14-18)11-12-23(21)15-20-8-6-5-7-16(20)2/h5-14H,4,15H2,1-3H3/b17-13+