3-[(phenylmethyl)-phosphono-amino]-2,3-dihydro-1H-indene-5-carboxylic acid

Systemtic Name: 3-[(phenylmethyl)-phosphono-amino]-2,3-dihydro-1H-indene-5-carboxylic acid Openeye Name: 3-[benzyl(phosphono)amino]indane-5-carboxylic acid CAS Name: 3-[(phenylmethyl)-phosphonoamino]-2,3-dihydro-1H-indene-5-carboxylic acid IUPAC Name: 3-[benzyl(phosphono)amino]-2,3-dihydro-1H-indene-5-carboxylic acid Traditional Name: 3-[benzyl(phosphono)amino]indane-5-carboxylic acid Formula: C17H18NO5P MolecularWeight: 347.302281

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1N(CC3=CC=CC=C3)P(=O)(O)O)C=C(C=C2)C(=O)O

Isomeric SMILES

C1CC2=C(C1N(CC3=CC=CC=C3)P(=O)(O)O)C=C(C=C2)C(=O)O

InChI

InChI=1S/C17H18NO5P/c19-17(20)14-7-6-13-8-9-16(15(13)10-14)18(24(21,22)23)11-12-4-2-1-3-5-12/h1-7,10,16H,8-9,11H2,(H,19,20)(H2,21,22,23)