methyl 2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]-3-(4-fluorophenyl)propanoate

Systemtic Name: methyl 2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]-3-(4-fluorophenyl)propanoate Openeye Name: methyl 2-[[5-(dimethylamino)-1-naphthyl]sulfonylamino]-3-(4-fluorophenyl)propanoate CAS Name: 2-[[5-(dimethylamino)-1-naphthalenyl]sulfonylamino]-3-(4-fluorophenyl)propanoic acid methyl ester IUPAC Name: methyl 2-[[5-(dimethylamino)naphthalen-1-yl]sulfonylamino]-3-(4-fluorophenyl)propanoate Traditional Name: 3-(4-fluorophenyl)-2-(naphthionylamino)propionic acid methyl ester Formula: C22H23FN2O4S MolecularWeight: 430.492423

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)NC(CC3=CC=C(C=C3)F)C(=O)OC

Isomeric SMILES

CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)NC(CC3=CC=C(C=C3)F)C(=O)OC

InChI

InChI=1S/C22H23FN2O4S/c1-25(2)20-8-4-7-18-17(20)6-5-9-21(18)30(27,28)24-19(22(26)29-3)14-15-10-12-16(23)13-11-15/h4-13,19,24H,14H2,1-3H3