2-[2-oxidanylidene-3-(phenylmethoxycarbonylamino)quinolin-1-ium-1-ylidene]ethanoic acid

Systemtic Name: 2-[2-oxidanylidene-3-(phenylmethoxycarbonylamino)quinolin-1-ium-1-ylidene]ethanoic acid Openeye Name: 2-[3-(benzyloxycarbonylamino)-2-oxo-quinolin-1-ium-1-ylidene]acetic acid CAS Name: 2-[2-oxo-3-(phenylmethoxycarbonylamino)-1-quinolin-1-iumylidene]acetic acid IUPAC Name: 2-[2-oxo-3-(phenylmethoxycarbonylamino)quinolin-1-ium-1-ylidene]acetic acid Traditional Name: 2-[3-(benzyloxycarbonylamino)-2-keto-quinolin-1-ium-1-ylidene]acetic acid Formula: C19H15N2O5+ MolecularWeight: 351.3328

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC2=CC3=CC=CC=C3[N+](=CC(=O)O)C2=O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC2=CC3=CC=CC=C3[N+](=CC(=O)O)C2=O

InChI

InChI=1S/C19H14N2O5/c22-17(23)11-21-16-9-5-4-8-14(16)10-15(18(21)24)20-19(25)26-12-13-6-2-1-3-7-13/h1-11H,12H2,(H-,20,22,23,25)/p+1