[2-chloranyl-1-(2-hexadecoxyphenyl)-1,3-bis(oxidanylidene)-3-phenylazanyl-propan-2-yl]sulfonyl-methoxy-dimethyl-azanium

Systemtic Name: [2-chloranyl-1-(2-hexadecoxyphenyl)-1,3-bis(oxidanylidene)-3-phenylazanyl-propan-2-yl]sulfonyl-methoxy-dimethyl-azanium Openeye Name: [2-anilino-1-chloro-1-(2-hexadecoxybenzoyl)-2-oxo-ethyl]sulfonyl-methoxy-dimethyl-ammonium CAS Name: [1-anilino-2-chloro-3-(2-hexadecoxyphenyl)-1,3-dioxopropan-2-yl]sulfonyl-methoxy-dimethylammonium IUPAC Name: [1-anilino-2-chloro-3-(2-hexadecoxyphenyl)-1,3-dioxopropan-2-yl]sulfonyl-methoxy-dimethylazanium Traditional Name: [2-anilino-1-(2-cetyloxybenzoyl)-1-chloro-2-keto-ethyl]sulfonyl-methoxy-dimethyl-ammonium Formula: C34H52ClN2O6S+ MolecularWeight: 652.30448

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC1=CC=CC=C1C(=O)C(C(=O)NC2=CC=CC=C2)(S(=O)(=O)[N+](C)(C)OC)Cl

Isomeric SMILES

CCCCCCCCCCCCCCCCOC1=CC=CC=C1C(=O)C(C(=O)NC2=CC=CC=C2)(S(=O)(=O)[N+](C)(C)OC)Cl

InChI

InChI=1S/C34H51ClN2O6S/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-23-28-43-31-27-22-21-26-30(31)32(38)34(35,44(40,41)37(2,3)42-4)33(39)36-29-24-19-18-20-25-29/h18-22,24-27H,5-17,23,28H2,1-4H3/p+1