3-(azepan-1-ylsulfonyl)-4-chloranyl-N-[(2R)-2-oxidanyl-2-phenyl-ethyl]benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-chloranyl-N-[(2R)-2-oxidanyl-2-phenyl-ethyl]benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[(2R)-2-hydroxy-2-phenyl-ethyl]benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-chloro-N-[(2R)-2-hydroxy-2-phenylethyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[(2R)-2-hydroxy-2-phenylethyl]benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[(2R)-2-hydroxy-2-phenyl-ethyl]benzamide Formula: C21H25ClN2O4S MolecularWeight: 436.9522

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NCC(C3=CC=CC=C3)O)Cl

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC[C@@H](C3=CC=CC=C3)O)Cl

InChI

InChI=1S/C21H25ClN2O4S/c22-18-11-10-17(21(26)23-15-19(25)16-8-4-3-5-9-16)14-20(18)29(27,28)24-12-6-1-2-7-13-24/h3-5,8-11,14,19,25H,1-2,6-7,12-13,15H2,(H,23,26)/t19-/m0/s1