[(2S)-1-(ethylcarbamoylamino)-1-oxidanylidene-propan-2-yl] (E)-3-(1,3-benzoxazol-2-yl)prop-2-enoate

Systemtic Name: [(2S)-1-(ethylcarbamoylamino)-1-oxidanylidene-propan-2-yl] (E)-3-(1,3-benzoxazol-2-yl)prop-2-enoate Openeye Name: [(1S)-2-(ethylcarbamoylamino)-1-methyl-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 [(2S)-1-(ethylcarbamoylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(ethylcarbamoylamino)-1-oxopropan-2-yl] (E)-3-(1,3-benzoxazol-2-yl)prop-2-enoate Traditional Name: (E)-3-(1,3-benzoxazol-2-yl)acrylic acid [(1S)-2-(ethylcarbamoylamino)-2-keto-1-methyl-ethyl] ester Formula: C16H17N3O5 MolecularWeight: 331.32328

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC(=O)C(C)OC(=O)C=CC1=NC2=CC=CC=C2O1

Isomeric SMILES

CCNC(=O)NC(=O)[C@H](C)OC(=O)/C=C/C1=NC2=CC=CC=C2O1

InChI

InChI=1S/C16H17N3O5/c1-3-17-16(22)19-15(21)10(2)23-14(20)9-8-13-18-11-6-4-5-7-12(11)24-13/h4-10H,3H2,1-2H3,(H2,17,19,21,22)/b9-8+/t10-/m0/s1