3-(azepan-1-ylsulfonyl)-N-[(2-methoxyphenyl)methyl]-N,4-dimethyl-benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-[(2-methoxyphenyl)methyl]-N,4-dimethyl-benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-[(2-methoxyphenyl)methyl]-N,4-dimethyl-benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-[(2-methoxyphenyl)methyl]-N,4-dimethylbenzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-[(2-methoxyphenyl)methyl]-N,4-dimethylbenzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N,4-dimethyl-N-o-anisyl-benzamide Formula: C23H30N2O4S MolecularWeight: 430.5603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N(C)CC2=CC=CC=C2OC)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N(C)CC2=CC=CC=C2OC)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C23H30N2O4S/c1-18-12-13-19(16-22(18)30(27,28)25-14-8-4-5-9-15-25)23(26)24(2)17-20-10-6-7-11-21(20)29-3/h6-7,10-13,16H,4-5,8-9,14-15,17H2,1-3H3