[1-(benzotriazol-1-yl)-2-(naphthalen-2-ylamino)-2-oxidanylidene-ethyl]phosphonic acid

Systemtic Name: [1-(benzotriazol-1-yl)-2-(naphthalen-2-ylamino)-2-oxidanylidene-ethyl]phosphonic acid Openeye Name: [1-(benzotriazol-1-yl)-2-(2-naphthylamino)-2-oxo-ethyl]phosphonic acid CAS Name: [1-(1-benzotriazolyl)-2-(2-naphthalenylamino)-2-oxoethyl]phosphonic acid IUPAC Name: [1-(benzotriazol-1-yl)-2-(naphthalen-2-ylamino)-2-oxoethyl]phosphonic acid Traditional Name: [1-(benzotriazol-1-yl)-2-keto-2-(2-naphthylamino)ethyl]phosphonic acid Formula: C18H15N4O4P MolecularWeight: 382.309861

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)NC(=O)C(N3C4=CC=CC=C4N=N3)P(=O)(O)O

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)NC(=O)C(N3C4=CC=CC=C4N=N3)P(=O)(O)O

InChI

InChI=1S/C18H15N4O4P/c23-17(19-14-10-9-12-5-1-2-6-13(12)11-14)18(27(24,25)26)22-16-8-4-3-7-15(16)20-21-22/h1-11,18H,(H,19,23)(H2,24,25,26)