[3-[1-(3-cyanophenyl)ethylamino]-2-oxidanyl-propyl]-(cyclohexylmethyl)phosphinic acid

Systemtic Name: [3-[1-(3-cyanophenyl)ethylamino]-2-oxidanyl-propyl]-(cyclohexylmethyl)phosphinic acid Openeye Name: [3-[1-(3-cyanophenyl)ethylamino]-2-hydroxy-propyl]-(cyclohexylmethyl)phosphinic acid CAS Name: [3-[1-(3-cyanophenyl)ethylamino]-2-hydroxypropyl]-(cyclohexylmethyl)phosphinic acid IUPAC Name: [3-[1-(3-cyanophenyl)ethylamino]-2-hydroxypropyl]-(cyclohexylmethyl)phosphinic acid Traditional Name: [3-[1-(3-cyanophenyl)ethylamino]-2-hydroxy-propyl]-(cyclohexylmethyl)phosphinic acid Formula: C19H29N2O3P MolecularWeight: 364.418921

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC(=C1)C#N)NCC(CP(=O)(CC2CCCCC2)O)O

Isomeric SMILES

CC(C1=CC=CC(=C1)C#N)NCC(CP(=O)(CC2CCCCC2)O)O

InChI

InChI=1S/C19H29N2O3P/c1-15(18-9-5-8-17(10-18)11-20)21-12-19(22)14-25(23,24)13-16-6-3-2-4-7-16/h5,8-10,15-16,19,21-22H,2-4,6-7,12-14H2,1H3,(H,23,24)