ethyl 5-[3-[3-(naphthalen-2-ylmethyl)-1,2,4-oxadiazol-5-yl]indol-1-yl]pentanoate

Systemtic Name: ethyl 5-[3-[3-(naphthalen-2-ylmethyl)-1,2,4-oxadiazol-5-yl]indol-1-yl]pentanoate Openeye Name: ethyl 5-[3-[3-(2-naphthylmethyl)-1,2,4-oxadiazol-5-yl]indol-1-yl]pentanoate CAS Name: 5-[3-[3-(2-naphthalenylmethyl)-1,2,4-oxadiazol-5-yl]-1-indolyl]pentanoic acid ethyl ester IUPAC Name: ethyl 5-[3-[3-(naphthalen-2-ylmethyl)-1,2,4-oxadiazol-5-yl]indol-1-yl]pentanoate Traditional Name: 5-[3-[3-(2-naphthylmethyl)-1,2,4-oxadiazol-5-yl]indol-1-yl]valeric acid ethyl ester Formula: C28H27N3O3 MolecularWeight: 453.53228

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCN1C=C(C2=CC=CC=C21)C3=NC(=NO3)CC4=CC5=CC=CC=C5C=C4

Isomeric SMILES

CCOC(=O)CCCCN1C=C(C2=CC=CC=C21)C3=NC(=NO3)CC4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C28H27N3O3/c1-2-33-27(32)13-7-8-16-31-19-24(23-11-5-6-12-25(23)31)28-29-26(30-34-28)18-20-14-15-21-9-3-4-10-22(21)17-20/h3-6,9-12,14-15,17,19H,2,7-8,13,16,18H2,1H3