3-[5-[(Z)-3-(aminocarbonylamino)-2-cyano-3-oxidanylidene-prop-1-enyl]furan-2-yl]-2-methyl-benzoate

Systemtic Name: 3-[5-[(Z)-3-(aminocarbonylamino)-2-cyano-3-oxidanylidene-prop-1-enyl]furan-2-yl]-2-methyl-benzoate Openeye Name: 3-[5-[(Z)-2-cyano-3-oxo-3-ureido-prop-1-enyl]-2-furyl]-2-methyl-benzoate CAS Name: 3-[5-[(Z)-3-(carbamoylamino)-2-cyano-3-oxoprop-1-enyl]-2-furanyl]-2-methylbenzoate IUPAC Name: 3-[5-[(Z)-3-(carbamoylamino)-2-cyano-3-oxoprop-1-enyl]furan-2-yl]-2-methylbenzoate Traditional Name: 3-[5-[(Z)-2-cyano-3-keto-3-ureido-prop-1-enyl]-2-furyl]-2-methyl-benzoate Formula: C17H12N3O5- MolecularWeight: 338.29428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1C(=O)[O-])C2=CC=C(O2)C=C(C#N)C(=O)NC(=O)N

Isomeric SMILES

CC1=C(C=CC=C1C(=O)[O-])C2=CC=C(O2)/C=C(/C#N)\C(=O)NC(=O)N

InChI

InChI=1S/C17H13N3O5/c1-9-12(3-2-4-13(9)16(22)23)14-6-5-11(25-14)7-10(8-18)15(21)20-17(19)24/h2-7H,1H3,(H,22,23)(H3,19,20,21,24)/p-1/b10-7-