ethyl (E)-3-(1-octan-4-ylindol-5-yl)but-2-enoate

Systemtic Name: ethyl (E)-3-(1-octan-4-ylindol-5-yl)but-2-enoate Openeye Name: ethyl (E)-3-[1-(1-propylpentyl)indol-5-yl]but-2-enoate CAS Name: (E)-3-(1-octan-4-yl-5-indolyl)-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-3-(1-octan-4-ylindol-5-yl)but-2-enoate Traditional Name: (E)-3-[1-(1-propylpentyl)indol-5-yl]but-2-enoic acid ethyl ester Formula: C22H31NO2 MolecularWeight: 341.48704

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCC)N1C=CC2=C1C=CC(=C2)C(=CC(=O)OCC)C

Isomeric SMILES

CCCCC(CCC)N1C=CC2=C1C=CC(=C2)/C(=C/C(=O)OCC)/C

InChI

InChI=1S/C22H31NO2/c1-5-8-10-20(9-6-2)23-14-13-19-16-18(11-12-21(19)23)17(4)15-22(24)25-7-3/h11-16,20H,5-10H2,1-4H3/b17-15+