methyl-[2-[(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]-[2-oxidanylidene-2-(propylamino)ethyl]azanium

Systemtic Name: methyl-[2-[(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl]-[2-oxidanylidene-2-(propylamino)ethyl]azanium Openeye Name: methyl-[2-[2-methyl-5-(1-piperidylsulfonyl)anilino]-2-oxo-ethyl]-[2-oxo-2-(propylamino)ethyl]ammonium CAS Name: methyl-[2-[2-methyl-5-(1-piperidinylsulfonyl)anilino]-2-oxoethyl]-[2-oxo-2-(propylamino)ethyl]ammonium IUPAC Name: methyl-[2-(2-methyl-5-piperidin-1-ylsulfonylanilino)-2-oxoethyl]-[2-oxo-2-(propylamino)ethyl]azanium Traditional Name: [2-keto-2-(2-methyl-5-piperidinosulfonyl-anilino)ethyl]-[2-keto-2-(propylamino)ethyl]-methyl-ammonium Formula: C20H33N4O4S+ MolecularWeight: 425.56542

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C[NH+](C)CC(=O)NC1=C(C=CC(=C1)S(=O)(=O)N2CCCCC2)C

Isomeric SMILES

CCCNC(=O)C[NH+](C)CC(=O)NC1=C(C=CC(=C1)S(=O)(=O)N2CCCCC2)C

InChI

InChI=1S/C20H32N4O4S/c1-4-10-21-19(25)14-23(3)15-20(26)22-18-13-17(9-8-16(18)2)29(27,28)24-11-6-5-7-12-24/h8-9,13H,4-7,10-12,14-15H2,1-3H3,(H,21,25)(H,22,26)/p+1