1-hexoxy-4-(hexylamino)-1,4-bis(oxidanylidene)butane-2-sulfonic acid

Systemtic Name: 1-hexoxy-4-(hexylamino)-1,4-bis(oxidanylidene)butane-2-sulfonic acid Openeye Name: 1-hexoxy-4-(hexylamino)-1,4-dioxo-butane-2-sulfonic acid CAS Name: 1-hexoxy-4-(hexylamino)-1,4-dioxo-2-butanesulfonic acid IUPAC Name: 1-hexoxy-4-(hexylamino)-1,4-dioxobutane-2-sulfonic acid Traditional Name: 1-hexoxy-4-(hexylamino)-1,4-diketo-butane-2-sulfonic acid Formula: C16H31NO6S MolecularWeight: 365.48544

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)CC(C(=O)OCCCCCC)S(=O)(=O)O

Isomeric SMILES

CCCCCCNC(=O)CC(C(=O)OCCCCCC)S(=O)(=O)O

InChI

InChI=1S/C16H31NO6S/c1-3-5-7-9-11-17-15(18)13-14(24(20,21)22)16(19)23-12-10-8-6-4-2/h14H,3-13H2,1-2H3,(H,17,18)(H,20,21,22)