N-[3-chloranyl-4-(2-methylpropoxy)phenyl]-4-methylsulfonyl-benzamide

Systemtic Name: N-[3-chloranyl-4-(2-methylpropoxy)phenyl]-4-methylsulfonyl-benzamide Openeye Name: N-(3-chloro-4-isobutoxy-phenyl)-4-methylsulfonyl-benzamide CAS Name: N-[3-chloro-4-(2-methylpropoxy)phenyl]-4-methylsulfonylbenzamide IUPAC Name: N-[3-chloro-4-(2-methylpropoxy)phenyl]-4-methylsulfonylbenzamide Traditional Name: N-(3-chloro-4-isobutoxy-phenyl)-4-mesyl-benzamide Formula: C18H20ClNO4S MolecularWeight: 381.8737

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)C)Cl

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)C)Cl

InChI

InChI=1S/C18H20ClNO4S/c1-12(2)11-24-17-9-6-14(10-16(17)19)20-18(21)13-4-7-15(8-5-13)25(3,22)23/h4-10,12H,11H2,1-3H3,(H,20,21)