(2S)-2-[[(2S)-2-(ethylsulfonylmethyl)-3-naphthalen-1-yl-propanoyl]amino]-3-oxidanyl-propanoic acid

Systemtic Name: (2S)-2-[[(2S)-2-(ethylsulfonylmethyl)-3-naphthalen-1-yl-propanoyl]amino]-3-oxidanyl-propanoic acid Openeye Name: (2S)-2-[[(2S)-2-(ethylsulfonylmethyl)-3-(1-naphthyl)propanoyl]amino]-3-hydroxy-propanoic acid CAS Name: (2S)-2-[[(2S)-2-(ethylsulfonylmethyl)-3-(1-naphthalenyl)-1-oxopropyl]amino]-3-hydroxypropanoic acid IUPAC Name: (2S)-2-[[(2S)-2-(ethylsulfonylmethyl)-3-naphthalen-1-ylpropanoyl]amino]-3-hydroxypropanoic acid Traditional Name: (2S)-2-[[(2S)-2-(esylmethyl)-3-(1-naphthyl)propanoyl]amino]-3-hydroxy-propionic acid Formula: C19H23NO6S MolecularWeight: 393.45402

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)CC(CC1=CC=CC2=CC=CC=C21)C(=O)NC(CO)C(=O)O

Isomeric SMILES

CCS(=O)(=O)C[C@@H](CC1=CC=CC2=CC=CC=C21)C(=O)N[C@@H](CO)C(=O)O

InChI

InChI=1S/C19H23NO6S/c1-2-27(25,26)12-15(18(22)20-17(11-21)19(23)24)10-14-8-5-7-13-6-3-4-9-16(13)14/h3-9,15,17,21H,2,10-12H2,1H3,(H,20,22)(H,23,24)/t15-,17+/m1/s1