ethyl 4-[3-(imidazol-1-ylmethyl)indol-1-yl]butanoate

Systemtic Name: ethyl 4-[3-(imidazol-1-ylmethyl)indol-1-yl]butanoate Openeye Name: ethyl 4-[3-(imidazol-1-ylmethyl)indol-1-yl]butanoate CAS Name: 4-[3-(1-imidazolylmethyl)-1-indolyl]butanoic acid ethyl ester IUPAC Name: ethyl 4-[3-(imidazol-1-ylmethyl)indol-1-yl]butanoate Traditional Name: 4-[3-(imidazol-1-ylmethyl)indol-1-yl]butyric acid ethyl ester Formula: C18H21N3O2 MolecularWeight: 311.37824

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCN1C=C(C2=CC=CC=C21)CN3C=CN=C3

Isomeric SMILES

CCOC(=O)CCCN1C=C(C2=CC=CC=C21)CN3C=CN=C3

InChI

InChI=1S/C18H21N3O2/c1-2-23-18(22)8-5-10-21-13-15(12-20-11-9-19-14-20)16-6-3-4-7-17(16)21/h3-4,6-7,9,11,13-14H,2,5,8,10,12H2,1H3