3-(azepan-1-ylsulfonyl)-4-chloranyl-N-[(3,4-dimethoxyphenyl)methyl]-N-ethyl-benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-chloranyl-N-[(3,4-dimethoxyphenyl)methyl]-N-ethyl-benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[(3,4-dimethoxyphenyl)methyl]-N-ethyl-benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-chloro-N-[(3,4-dimethoxyphenyl)methyl]-N-ethylbenzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[(3,4-dimethoxyphenyl)methyl]-N-ethylbenzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-ethyl-N-veratryl-benzamide Formula: C24H31ClN2O5S MolecularWeight: 495.03134

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC(=C(C=C1)OC)OC)C(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CCN(CC1=CC(=C(C=C1)OC)OC)C(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C24H31ClN2O5S/c1-4-26(17-18-9-12-21(31-2)22(15-18)32-3)24(28)19-10-11-20(25)23(16-19)33(29,30)27-13-7-5-6-8-14-27/h9-12,15-16H,4-8,13-14,17H2,1-3H3