7-[[4-(1-oxa-4,10-dithia-7-azoniacyclododec-7-ylmethyl)phenyl]methyl]-1-oxa-4,10-dithia-7-azoniacyclododecane

Systemtic Name: 7-[[4-(1-oxa-4,10-dithia-7-azoniacyclododec-7-ylmethyl)phenyl]methyl]-1-oxa-4,10-dithia-7-azoniacyclododecane Openeye Name: 7-[[4-(1-oxa-4,10-dithia-7-azoniacyclododec-7-ylmethyl)phenyl]methyl]-1-oxa-4,10-dithia-7-azoniacyclododecane CAS Name: 7-[[4-(1-oxa-4,10-dithia-7-azoniacyclododec-7-ylmethyl)phenyl]methyl]-1-oxa-4,10-dithia-7-azoniacyclododecane IUPAC Name: 7-[[4-(1-oxa-4,10-dithia-7-azoniacyclododec-7-ylmethyl)phenyl]methyl]-1-oxa-4,10-dithia-7-azoniacyclododecane Traditional Name: 7-[4-(1-oxa-4,10-dithia-7-azoniacyclododec-7-ylmethyl)benzyl]-1-oxa-4,10-dithia-7-azoniacyclododecane Formula: C24H42N2O2S4+2 MolecularWeight: 518.86248

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCCOCCSCC[NH+]1CC2=CC=C(C=C2)C[NH+]3CCSCCOCCSCC3

Isomeric SMILES

C1CSCCOCCSCC[NH+]1CC2=CC=C(C=C2)C[NH+]3CCSCCOCCSCC3

InChI

InChI=1S/C24H40N2O2S4/c1-2-24(22-26-7-15-31-19-11-28-12-20-32-16-8-26)4-3-23(1)21-25-5-13-29-17-9-27-10-18-30-14-6-25/h1-4H,5-22H2/p+2