2-[2-[[1-(naphthalen-1-ylmethyl)pyrazol-4-yl]amino]-2-oxidanylidene-ethoxy]ethanoic acid

Systemtic Name: 2-[2-[[1-(naphthalen-1-ylmethyl)pyrazol-4-yl]amino]-2-oxidanylidene-ethoxy]ethanoic acid Openeye Name: 2-[2-[[1-(1-naphthylmethyl)pyrazol-4-yl]amino]-2-oxo-ethoxy]acetic acid CAS Name: 2-[2-[[1-(1-naphthalenylmethyl)-4-pyrazolyl]amino]-2-oxoethoxy]acetic acid IUPAC Name: 2-[2-[[1-(naphthalen-1-ylmethyl)pyrazol-4-yl]amino]-2-oxoethoxy]acetic acid Traditional Name: 2-[2-keto-2-[[1-(1-naphthylmethyl)pyrazol-4-yl]amino]ethoxy]acetic acid Formula: C18H17N3O4 MolecularWeight: 339.34528

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2CN3C=C(C=N3)NC(=O)COCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2CN3C=C(C=N3)NC(=O)COCC(=O)O

InChI

InChI=1S/C18H17N3O4/c22-17(11-25-12-18(23)24)20-15-8-19-21(10-15)9-14-6-3-5-13-4-1-2-7-16(13)14/h1-8,10H,9,11-12H2,(H,20,22)(H,23,24)