4-chloranyl-N-[[4-(methoxymethyl)phenyl]methyl]-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: 4-chloranyl-N-[[4-(methoxymethyl)phenyl]methyl]-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: 4-chloro-N-[[4-(methoxymethyl)phenyl]methyl]-3-(1-piperidylsulfonyl)benzamide CAS Name: 4-chloro-N-[[4-(methoxymethyl)phenyl]methyl]-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: 4-chloro-N-[[4-(methoxymethyl)phenyl]methyl]-3-piperidin-1-ylsulfonylbenzamide Traditional Name: 4-chloro-N-[4-(methoxymethyl)benzyl]-3-piperidinosulfonyl-benzamide Formula: C21H25ClN2O4S MolecularWeight: 436.9522

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=CC=C(C=C1)CNC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCC3

Isomeric SMILES

COCC1=CC=C(C=C1)CNC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C21H25ClN2O4S/c1-28-15-17-7-5-16(6-8-17)14-23-21(25)18-9-10-19(22)20(13-18)29(26,27)24-11-3-2-4-12-24/h5-10,13H,2-4,11-12,14-15H2,1H3,(H,23,25)