1,4-bis(azanyl)-4-cyclopentyl-3-oxidanyl-2,6-bis(oxidanylidene)-5-phenyl-6-phenylmethoxy-hexane-3-sulfonic acid

Systemtic Name: 1,4-bis(azanyl)-4-cyclopentyl-3-oxidanyl-2,6-bis(oxidanylidene)-5-phenyl-6-phenylmethoxy-hexane-3-sulfonic acid Openeye Name: 1,4-diamino-6-benzyloxy-4-cyclopentyl-3-hydroxy-2,6-dioxo-5-phenyl-hexane-3-sulfonic acid CAS Name: 1,4-diamino-4-cyclopentyl-3-hydroxy-2,6-dioxo-5-phenyl-6-phenylmethoxy-3-hexanesulfonic acid IUPAC Name: 1,4-diamino-4-cyclopentyl-3-hydroxy-2,6-dioxo-5-phenyl-6-phenylmethoxyhexane-3-sulfonic acid Traditional Name: 1,4-diamino-6-benzoxy-4-cyclopentyl-3-hydroxy-2,6-diketo-5-phenyl-hexane-3-sulfonic acid Formula: C24H30N2O7S MolecularWeight: 490.5692

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(C(C2=CC=CC=C2)C(=O)OCC3=CC=CC=C3)(C(C(=O)CN)(O)S(=O)(=O)O)N

Isomeric SMILES

C1CCC(C1)C(C(C2=CC=CC=C2)C(=O)OCC3=CC=CC=C3)(C(C(=O)CN)(O)S(=O)(=O)O)N

InChI

InChI=1S/C24H30N2O7S/c25-15-20(27)24(29,34(30,31)32)23(26,19-13-7-8-14-19)21(18-11-5-2-6-12-18)22(28)33-16-17-9-3-1-4-10-17/h1-6,9-12,19,21,29H,7-8,13-16,25-26H2,(H,30,31,32)