[2-[(2-chloranyl-5-piperidin-1-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]-(pyridin-4-ylmethyl)azanium

Systemtic Name: [2-[(2-chloranyl-5-piperidin-1-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]-(pyridin-4-ylmethyl)azanium Openeye Name: [2-[2-chloro-5-(1-piperidylsulfonyl)anilino]-2-oxo-ethyl]-(4-pyridylmethyl)ammonium CAS Name: [2-[2-chloro-5-(1-piperidinylsulfonyl)anilino]-2-oxoethyl]-(pyridin-4-ylmethyl)ammonium IUPAC Name: [2-(2-chloro-5-piperidin-1-ylsulfonylanilino)-2-oxoethyl]-(pyridin-4-ylmethyl)azanium Traditional Name: [2-(2-chloro-5-piperidinosulfonyl-anilino)-2-keto-ethyl]-(4-pyridylmethyl)ammonium Formula: C19H24ClN4O3S+ MolecularWeight: 423.93686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)NC(=O)C[NH2+]CC3=CC=NC=C3

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)NC(=O)C[NH2+]CC3=CC=NC=C3

InChI

InChI=1S/C19H23ClN4O3S/c20-17-5-4-16(28(26,27)24-10-2-1-3-11-24)12-18(17)23-19(25)14-22-13-15-6-8-21-9-7-15/h4-9,12,22H,1-3,10-11,13-14H2,(H,23,25)/p+1