N-(1-adamantyl)-4-methoxy-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(1-adamantyl)-4-methoxy-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(1-adamantyl)-4-methoxy-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-(1-adamantyl)-4-methoxy-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(1-adamantyl)-4-methoxy-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-(1-adamantyl)-4-methoxy-3-pyrrolidinosulfonyl-benzamide Formula: C22H30N2O4S MolecularWeight: 418.5496

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC23CC4CC(C2)CC(C4)C3)S(=O)(=O)N5CCCC5

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC23CC4CC(C2)CC(C4)C3)S(=O)(=O)N5CCCC5

InChI

InChI=1S/C22H30N2O4S/c1-28-19-5-4-18(11-20(19)29(26,27)24-6-2-3-7-24)21(25)23-22-12-15-8-16(13-22)10-17(9-15)14-22/h4-5,11,15-17H,2-3,6-10,12-14H2,1H3,(H,23,25)