4-[3-(aminocarbonylamino)-3-oxidanylidene-propoxy]-3-methoxy-benzoic acid

Systemtic Name: 4-[3-(aminocarbonylamino)-3-oxidanylidene-propoxy]-3-methoxy-benzoic acid Openeye Name: 3-methoxy-4-(3-oxo-3-ureido-propoxy)benzoic acid CAS Name: 4-[3-(carbamoylamino)-3-oxopropoxy]-3-methoxybenzoic acid IUPAC Name: 4-[3-(carbamoylamino)-3-oxopropoxy]-3-methoxybenzoic acid Traditional Name: 4-(3-keto-3-ureido-propoxy)-3-methoxy-benzoic acid Formula: C12H14N2O6 MolecularWeight: 282.24936

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)O)OCCC(=O)NC(=O)N

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)O)OCCC(=O)NC(=O)N

InChI

InChI=1S/C12H14N2O6/c1-19-9-6-7(11(16)17)2-3-8(9)20-5-4-10(15)14-12(13)18/h2-3,6H,4-5H2,1H3,(H,16,17)(H3,13,14,15,18)