(2S)-3-methyl-2-[naphthalen-1-ylsulfonyl-(phenylmethyl)amino]butanoic acid

Systemtic Name: (2S)-3-methyl-2-[naphthalen-1-ylsulfonyl-(phenylmethyl)amino]butanoic acid Openeye Name: (2S)-2-[benzyl(1-naphthylsulfonyl)amino]-3-methyl-butanoic acid CAS Name: (2S)-3-methyl-2-[1-naphthalenylsulfonyl-(phenylmethyl)amino]butanoic acid IUPAC Name: (2S)-2-[benzyl(naphthalen-1-ylsulfonyl)amino]-3-methylbutanoic acid Traditional Name: (2S)-2-[benzyl(1-naphthylsulfonyl)amino]-3-methyl-butyric acid Formula: C22H23NO4S MolecularWeight: 397.48732

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)N(CC1=CC=CC=C1)S(=O)(=O)C2=CC=CC3=CC=CC=C32

Isomeric SMILES

CC(C)[C@@H](C(=O)O)N(CC1=CC=CC=C1)S(=O)(=O)C2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C22H23NO4S/c1-16(2)21(22(24)25)23(15-17-9-4-3-5-10-17)28(26,27)20-14-8-12-18-11-6-7-13-19(18)20/h3-14,16,21H,15H2,1-2H3,(H,24,25)/t21-/m0/s1