(2S)-2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]-3-phenyl-propanoate

Systemtic Name: (2S)-2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]-3-phenyl-propanoate Openeye Name: (2S)-2-[[5-(dimethylamino)-1-naphthyl]sulfonylamino]-3-phenyl-propanoate CAS Name: (2S)-2-[[5-(dimethylamino)-1-naphthalenyl]sulfonylamino]-3-phenylpropanoate IUPAC Name: (2S)-2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]-3-phenylpropanoate Traditional Name: (2S)-2-(naphthionylamino)-3-phenyl-propionate Formula: C21H21N2O4S- MolecularWeight: 397.46744

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)NC(CC3=CC=CC=C3)C(=O)[O-]

Isomeric SMILES

CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)N[C@@H](CC3=CC=CC=C3)C(=O)[O-]

InChI

InChI=1S/C21H22N2O4S/c1-23(2)19-12-6-11-17-16(19)10-7-13-20(17)28(26,27)22-18(21(24)25)14-15-8-4-3-5-9-15/h3-13,18,22H,14H2,1-2H3,(H,24,25)/p-1/t18-/m0/s1