3-(azepan-1-ylsulfonyl)-4-chloranyl-N-pentan-3-yl-benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-chloranyl-N-pentan-3-yl-benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-(1-ethylpropyl)benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-chloro-N-pentan-3-ylbenzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-pentan-3-ylbenzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-(1-ethylpropyl)benzamide Formula: C18H27ClN2O3S MolecularWeight: 386.93658

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)N2CCCCCC2

Isomeric SMILES

CCC(CC)NC(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)N2CCCCCC2

InChI

InChI=1S/C18H27ClN2O3S/c1-3-15(4-2)20-18(22)14-9-10-16(19)17(13-14)25(23,24)21-11-7-5-6-8-12-21/h9-10,13,15H,3-8,11-12H2,1-2H3,(H,20,22)