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

Systemtic Name: [2-(hexylamino)-2-oxidanylidene-ethyl] (E)-3-(1,3-benzoxazol-2-yl)prop-2-enoate Openeye Name: [2-(hexylamino)-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-(hexylamino)-2-oxoethyl] ester IUPAC Name: [2-(hexylamino)-2-oxoethyl] (E)-3-(1,3-benzoxazol-2-yl)prop-2-enoate Traditional Name: (E)-3-(1,3-benzoxazol-2-yl)acrylic acid [2-(hexylamino)-2-keto-ethyl] ester Formula: C18H22N2O4 MolecularWeight: 330.37828

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)COC(=O)C=CC1=NC2=CC=CC=C2O1

Isomeric SMILES

CCCCCCNC(=O)COC(=O)/C=C/C1=NC2=CC=CC=C2O1

InChI

InChI=1S/C18H22N2O4/c1-2-3-4-7-12-19-16(21)13-23-18(22)11-10-17-20-14-8-5-6-9-15(14)24-17/h5-6,8-11H,2-4,7,12-13H2,1H3,(H,19,21)/b11-10+