N-[4-(azepan-1-ylsulfonyl)phenyl]-3-(2,3-dimethoxyphenyl)propanamide

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-3-(2,3-dimethoxyphenyl)propanamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-3-(2,3-dimethoxyphenyl)propanamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-3-(2,3-dimethoxyphenyl)propanamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-3-(2,3-dimethoxyphenyl)propanamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-3-(2,3-dimethoxyphenyl)propionamide Formula: C23H30N2O5S MolecularWeight: 446.5597

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)CCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

COC1=CC=CC(=C1OC)CCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C23H30N2O5S/c1-29-21-9-7-8-18(23(21)30-2)10-15-22(26)24-19-11-13-20(14-12-19)31(27,28)25-16-5-3-4-6-17-25/h7-9,11-14H,3-6,10,15-17H2,1-2H3,(H,24,26)