1,7,10,13-tetraethyl-4-(4-methylphenyl)sulfonyl-1,4,7,10,13-pentazacyclopentadecane-2,6-dione

Systemtic Name: 1,7,10,13-tetraethyl-4-(4-methylphenyl)sulfonyl-1,4,7,10,13-pentazacyclopentadecane-2,6-dione Openeye Name: 1,7,10,13-tetraethyl-4-(p-tolylsulfonyl)-1,4,7,10,13-pentazacyclopentadecane-2,6-dione CAS Name: 1,7,10,13-tetraethyl-4-(4-methylphenyl)sulfonyl-1,4,7,10,13-pentazacyclopentadecane-2,6-dione IUPAC Name: 1,7,10,13-tetraethyl-4-(4-methylphenyl)sulfonyl-1,4,7,10,13-pentazacyclopentadecane-2,6-dione Traditional Name: 1,7,10,13-tetraethyl-4-tosyl-1,4,7,10,13-pentazacyclopentadecane-2,6-quinone Formula: C25H43N5O4S MolecularWeight: 509.70502

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CCN(C(=O)CN(CC(=O)N(CC1)CC)S(=O)(=O)C2=CC=C(C=C2)C)CC)CC

Isomeric SMILES

CCN1CCN(CCN(C(=O)CN(CC(=O)N(CC1)CC)S(=O)(=O)C2=CC=C(C=C2)C)CC)CC

InChI

InChI=1S/C25H43N5O4S/c1-6-26-14-15-27(7-2)17-19-29(9-4)25(32)21-30(20-24(31)28(8-3)18-16-26)35(33,34)23-12-10-22(5)11-13-23/h10-13H,6-9,14-21H2,1-5H3