2-[6-oxidanylidene-3-[1-(phenylmethoxycarbonylamino)ethyl]pyridazin-1-yl]ethanoic acid

Systemtic Name: 2-[6-oxidanylidene-3-[1-(phenylmethoxycarbonylamino)ethyl]pyridazin-1-yl]ethanoic acid Openeye Name: 2-[3-[1-(benzyloxycarbonylamino)ethyl]-6-oxo-pyridazin-1-yl]acetic acid CAS Name: 2-[6-oxo-3-[1-(phenylmethoxycarbonylamino)ethyl]-1-pyridazinyl]acetic acid IUPAC Name: 2-[6-oxo-3-[1-(phenylmethoxycarbonylamino)ethyl]pyridazin-1-yl]acetic acid Traditional Name: 2-[3-[1-(benzyloxycarbonylamino)ethyl]-6-keto-pyridazin-1-yl]acetic acid Formula: C16H17N3O5 MolecularWeight: 331.32328

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NN(C(=O)C=C1)CC(=O)O)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C1=NN(C(=O)C=C1)CC(=O)O)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C16H17N3O5/c1-11(13-7-8-14(20)19(18-13)9-15(21)22)17-16(23)24-10-12-5-3-2-4-6-12/h2-8,11H,9-10H2,1H3,(H,17,23)(H,21,22)