1-[2-oxidanylidene-2-[(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)amino]ethyl]cycloheptane-1-carboxylic acid

Systemtic Name: 1-[2-oxidanylidene-2-[(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)amino]ethyl]cycloheptane-1-carboxylic acid Openeye Name: 1-[2-oxo-2-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]ethyl]cycloheptanecarboxylic acid CAS Name: 1-[2-oxo-2-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]ethyl]-1-cycloheptanecarboxylic acid IUPAC Name: 1-[2-oxo-2-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]ethyl]cycloheptane-1-carboxylic acid Traditional Name: 1-[2-keto-2-[(2-keto-1,3-dihydrobenzimidazol-5-yl)amino]ethyl]cycloheptanecarboxylic acid Formula: C17H21N3O4 MolecularWeight: 331.36634

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)(CC(=O)NC2=CC3=C(C=C2)NC(=O)N3)C(=O)O

Isomeric SMILES

C1CCCC(CC1)(CC(=O)NC2=CC3=C(C=C2)NC(=O)N3)C(=O)O

InChI

InChI=1S/C17H21N3O4/c21-14(10-17(15(22)23)7-3-1-2-4-8-17)18-11-5-6-12-13(9-11)20-16(24)19-12/h5-6,9H,1-4,7-8,10H2,(H,18,21)(H,22,23)(H2,19,20,24)