[3-[1-(3,4-dimethoxyphenyl)ethylamino]-2-oxidanyl-propyl]-(phenylmethyl)phosphinic acid

Systemtic Name: [3-[1-(3,4-dimethoxyphenyl)ethylamino]-2-oxidanyl-propyl]-(phenylmethyl)phosphinic acid Openeye Name: benzyl-[3-[1-(3,4-dimethoxyphenyl)ethylamino]-2-hydroxy-propyl]phosphinic acid CAS Name: [3-[1-(3,4-dimethoxyphenyl)ethylamino]-2-hydroxypropyl]-(phenylmethyl)phosphinic acid IUPAC Name: benzyl-[3-[1-(3,4-dimethoxyphenyl)ethylamino]-2-hydroxypropyl]phosphinic acid Traditional Name: benzyl-[3-[1-(3,4-dimethoxyphenyl)ethylamino]-2-hydroxy-propyl]phosphinic acid Formula: C20H28NO5P MolecularWeight: 393.413781

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)OC)OC)NCC(CP(=O)(CC2=CC=CC=C2)O)O

Isomeric SMILES

CC(C1=CC(=C(C=C1)OC)OC)NCC(CP(=O)(CC2=CC=CC=C2)O)O

InChI

InChI=1S/C20H28NO5P/c1-15(17-9-10-19(25-2)20(11-17)26-3)21-12-18(22)14-27(23,24)13-16-7-5-4-6-8-16/h4-11,15,18,21-22H,12-14H2,1-3H3,(H,23,24)