[(2S)-1-ethoxy-1-oxidanylidene-3-(phenethylamino)propan-2-yl]-(phenylmethyl)sulfamic acid

Systemtic Name: [(2S)-1-ethoxy-1-oxidanylidene-3-(phenethylamino)propan-2-yl]-(phenylmethyl)sulfamic acid Openeye Name: benzyl-[(1S)-2-ethoxy-2-oxo-1-[(phenethylamino)methyl]ethyl]sulfamic acid CAS Name: [(2S)-1-ethoxy-1-oxo-3-(phenethylamino)propan-2-yl]-(phenylmethyl)sulfamic acid IUPAC Name: benzyl-[(2S)-1-ethoxy-1-oxo-3-(phenethylamino)propan-2-yl]sulfamic acid Traditional Name: benzyl-[(1S)-2-ethoxy-2-keto-1-[(phenethylamino)methyl]ethyl]sulfamic acid Formula: C20H26N2O5S MolecularWeight: 406.49584

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CNCCC1=CC=CC=C1)N(CC2=CC=CC=C2)S(=O)(=O)O

Isomeric SMILES

CCOC(=O)[C@H](CNCCC1=CC=CC=C1)N(CC2=CC=CC=C2)S(=O)(=O)O

InChI

InChI=1S/C20H26N2O5S/c1-2-27-20(23)19(15-21-14-13-17-9-5-3-6-10-17)22(28(24,25)26)16-18-11-7-4-8-12-18/h3-12,19,21H,2,13-16H2,1H3,(H,24,25,26)/t19-/m0/s1