1-(2-chloroethylsulfonyl)-4-methyl-benzene; 1,4,7,10,13,16-hexaoxacyclooctadecane

Systemtic Name: 1-(2-chloroethylsulfonyl)-4-methyl-benzene; 1,4,7,10,13,16-hexaoxacyclooctadecane Openeye Name: 1-(2-chloroethylsulfonyl)-4-methyl-benzene; 1,4,7,10,13,16-hexaoxacyclooctadecane CAS Name: 1-(2-chloroethylsulfonyl)-4-methylbenzene; 1,4,7,10,13,16-hexaoxacyclooctadecane IUPAC Name: 1-(2-chloroethylsulfonyl)-4-methylbenzene; 1,4,7,10,13,16-hexaoxacyclooctadecane Traditional Name: 1-(2-chloroethylsulfonyl)-4-methyl-benzene; 18-crown-6 Formula: C30H46Cl2O10S2 MolecularWeight: 701.71624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCCl.CC1=CC=C(C=C1)S(=O)(=O)CCCl.C1COCCOCCOCCOCCOCCO1

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCCl.CC1=CC=C(C=C1)S(=O)(=O)CCCl.C1COCCOCCOCCOCCOCCO1

InChI

InChI=1S/C12H24O6.2C9H11ClO2S/c1-2-14-5-6-16-9-10-18-12-11-17-8-7-15-4-3-13-1;2*1-8-2-4-9(5-3-8)13(11,12)7-6-10/h1-12H2;2*2-5H,6-7H2,1H3