ethyl (E)-4-(benzotriazol-1-yl)-4-ethoxy-non-5-enoate

Systemtic Name: ethyl (E)-4-(benzotriazol-1-yl)-4-ethoxy-non-5-enoate Openeye Name: ethyl (E)-4-(benzotriazol-1-yl)-4-ethoxy-non-5-enoate CAS Name: (E)-4-(1-benzotriazolyl)-4-ethoxy-5-nonenoic acid ethyl ester IUPAC Name: ethyl (E)-4-(benzotriazol-1-yl)-4-ethoxynon-5-enoate Traditional Name: (E)-4-(benzotriazol-1-yl)-4-ethoxy-non-5-enoic acid ethyl ester Formula: C19H27N3O3 MolecularWeight: 345.43598

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Descriptors Computed from Structure

Canonical SMILES:

CCCC=CC(CCC(=O)OCC)(N1C2=CC=CC=C2N=N1)OCC

Isomeric SMILES

CCC/C=C/C(CCC(=O)OCC)(N1C2=CC=CC=C2N=N1)OCC

InChI

InChI=1S/C19H27N3O3/c1-4-7-10-14-19(25-6-3,15-13-18(23)24-5-2)22-17-12-9-8-11-16(17)20-21-22/h8-12,14H,4-7,13,15H2,1-3H3/b14-10+