[2-(azocan-1-yl)-2-oxidanylidene-ethyl] (E)-3-(1,3-benzoxazol-2-yl)prop-2-enoate

Systemtic Name: [2-(azocan-1-yl)-2-oxidanylidene-ethyl] (E)-3-(1,3-benzoxazol-2-yl)prop-2-enoate Openeye Name: [2-(azocan-1-yl)-2-oxo-ethyl] (E)-3-(1,3-benzoxazol-2-yl)prop-2-enoate CAS Name: (E)-3-(1,3-benzoxazol-2-yl)-2-propenoic acid [2-(1-azocanyl)-2-oxoethyl] ester IUPAC Name: [2-(azocan-1-yl)-2-oxoethyl] (E)-3-(1,3-benzoxazol-2-yl)prop-2-enoate Traditional Name: (E)-3-(1,3-benzoxazol-2-yl)acrylic acid [2-(azocan-1-yl)-2-keto-ethyl] ester Formula: C19H22N2O4 MolecularWeight: 342.38898

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CCC1)C(=O)COC(=O)C=CC2=NC3=CC=CC=C3O2

Isomeric SMILES

C1CCCN(CCC1)C(=O)COC(=O)/C=C/C2=NC3=CC=CC=C3O2

InChI

InChI=1S/C19H22N2O4/c22-18(21-12-6-2-1-3-7-13-21)14-24-19(23)11-10-17-20-15-8-4-5-9-16(15)25-17/h4-5,8-11H,1-3,6-7,12-14H2/b11-10+