N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-5-morpholin-4-ylsulfonyl-pyridin-2-amine

Systemtic Name: N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-5-morpholin-4-ylsulfonyl-pyridin-2-amine Openeye Name: N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-5-morpholinosulfonyl-pyridin-2-amine CAS Name: N-[1-[(4-chlorophenyl)methyl]-4-piperidin-1-iumyl]-5-(4-morpholinylsulfonyl)-2-pyridinamine IUPAC Name: N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-5-morpholin-4-ylsulfonylpyridin-2-amine Traditional Name: [1-(4-chlorobenzyl)piperidin-1-ium-4-yl]-(5-morpholinosulfonyl-2-pyridyl)amine Formula: C21H28ClN4O3S+ MolecularWeight: 451.99002

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC2=NC=C(C=C2)S(=O)(=O)N3CCOCC3)CC4=CC=C(C=C4)Cl

Isomeric SMILES

C1C[NH+](CCC1NC2=NC=C(C=C2)S(=O)(=O)N3CCOCC3)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H27ClN4O3S/c22-18-3-1-17(2-4-18)16-25-9-7-19(8-10-25)24-21-6-5-20(15-23-21)30(27,28)26-11-13-29-14-12-26/h1-6,15,19H,7-14,16H2,(H,23,24)/p+1