(2-methoxy-5-methyl-phenyl)-(3-methylsulfonylphenyl)methanamine

Systemtic Name: (2-methoxy-5-methyl-phenyl)-(3-methylsulfonylphenyl)methanamine Openeye Name: (2-methoxy-5-methyl-phenyl)-(3-methylsulfonylphenyl)methanamine CAS Name: (2-methoxy-5-methylphenyl)-(3-methylsulfonylphenyl)methanamine IUPAC Name: (2-methoxy-5-methylphenyl)-(3-methylsulfonylphenyl)methanamine Traditional Name: [(3-mesylphenyl)-(2-methoxy-5-methyl-phenyl)methyl]amine Formula: C16H19NO3S MolecularWeight: 305.39196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C(C2=CC(=CC=C2)S(=O)(=O)C)N

Isomeric SMILES

CC1=CC(=C(C=C1)OC)C(C2=CC(=CC=C2)S(=O)(=O)C)N

InChI

InChI=1S/C16H19NO3S/c1-11-7-8-15(20-2)14(9-11)16(17)12-5-4-6-13(10-12)21(3,18)19/h4-10,16H,17H2,1-3H3