2-azanyl-3-(4-methoxyphenyl)sulfonyl-6-methyl-4-(phenylmethyl)benzoic acid

Systemtic Name: 2-azanyl-3-(4-methoxyphenyl)sulfonyl-6-methyl-4-(phenylmethyl)benzoic acid Openeye Name: 2-amino-4-benzyl-3-(4-methoxyphenyl)sulfonyl-6-methyl-benzoic acid CAS Name: 2-amino-3-(4-methoxyphenyl)sulfonyl-6-methyl-4-(phenylmethyl)benzoic acid IUPAC Name: 2-amino-4-benzyl-3-(4-methoxyphenyl)sulfonyl-6-methylbenzoic acid Traditional Name: 2-amino-4-benzyl-3-(4-methoxyphenyl)sulfonyl-6-methyl-benzoic acid Formula: C22H21NO5S MolecularWeight: 411.47084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C(=O)O)N)S(=O)(=O)C2=CC=C(C=C2)OC)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C(=C1C(=O)O)N)S(=O)(=O)C2=CC=C(C=C2)OC)CC3=CC=CC=C3

InChI

InChI=1S/C22H21NO5S/c1-14-12-16(13-15-6-4-3-5-7-15)21(20(23)19(14)22(24)25)29(26,27)18-10-8-17(28-2)9-11-18/h3-12H,13,23H2,1-2H3,(H,24,25)