ethyl 4-[3-(2-imidazol-1-ylethyl)-2,3-dihydroindol-1-yl]butanoate

Systemtic Name: ethyl 4-[3-(2-imidazol-1-ylethyl)-2,3-dihydroindol-1-yl]butanoate Openeye Name: ethyl 4-[3-(2-imidazol-1-ylethyl)indolin-1-yl]butanoate CAS Name: 4-[3-[2-(1-imidazolyl)ethyl]-2,3-dihydroindol-1-yl]butanoic acid ethyl ester IUPAC Name: ethyl 4-[3-(2-imidazol-1-ylethyl)-2,3-dihydroindol-1-yl]butanoate Traditional Name: 4-[3-(2-imidazol-1-ylethyl)indolin-1-yl]butyric acid ethyl ester Formula: C19H25N3O2 MolecularWeight: 327.4207

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCN1CC(C2=CC=CC=C21)CCN3C=CN=C3

Isomeric SMILES

CCOC(=O)CCCN1CC(C2=CC=CC=C21)CCN3C=CN=C3

InChI

InChI=1S/C19H25N3O2/c1-2-24-19(23)8-5-11-22-14-16(9-12-21-13-10-20-15-21)17-6-3-4-7-18(17)22/h3-4,6-7,10,13,15-16H,2,5,8-9,11-12,14H2,1H3