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

Systemtic Name: ethyl (E)-3-[1-(1-phenylbutyl)indol-5-yl]but-2-enoate Openeye Name: ethyl (E)-3-[1-(1-phenylbutyl)indol-5-yl]but-2-enoate CAS Name: (E)-3-[1-(1-phenylbutyl)-5-indolyl]-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[1-(1-phenylbutyl)indol-5-yl]but-2-enoate Traditional Name: (E)-3-[1-(1-phenylbutyl)indol-5-yl]but-2-enoic acid ethyl ester Formula: C24H27NO2 MolecularWeight: 361.47668

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC=C1)N2C=CC3=C2C=CC(=C3)C(=CC(=O)OCC)C

Isomeric SMILES

CCCC(C1=CC=CC=C1)N2C=CC3=C2C=CC(=C3)/C(=C/C(=O)OCC)/C

InChI

InChI=1S/C24H27NO2/c1-4-9-22(19-10-7-6-8-11-19)25-15-14-21-17-20(12-13-23(21)25)18(3)16-24(26)27-5-2/h6-8,10-17,22H,4-5,9H2,1-3H3/b18-16+