ethyl (E)-3-[1-(phenylmethyl)indol-7-yl]but-2-enoate

Systemtic Name: ethyl (E)-3-[1-(phenylmethyl)indol-7-yl]but-2-enoate Openeye Name: ethyl (E)-3-(1-benzylindol-7-yl)but-2-enoate CAS Name: (E)-3-[1-(phenylmethyl)-7-indolyl]-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-3-(1-benzylindol-7-yl)but-2-enoate Traditional Name: (E)-3-(1-benzylindol-7-yl)but-2-enoic acid ethyl ester Formula: C21H21NO2 MolecularWeight: 319.39694

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=C(C)C1=CC=CC2=C1N(C=C2)CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)/C=C(\C)/C1=CC=CC2=C1N(C=C2)CC3=CC=CC=C3

InChI

InChI=1S/C21H21NO2/c1-3-24-20(23)14-16(2)19-11-7-10-18-12-13-22(21(18)19)15-17-8-5-4-6-9-17/h4-14H,3,15H2,1-2H3/b16-14+