[4-[4-(3-oxidanylidene-3-phenylmethoxy-propyl)phenoxy]carbonylcyclohexyl]methylazanium

Systemtic Name: [4-[4-(3-oxidanylidene-3-phenylmethoxy-propyl)phenoxy]carbonylcyclohexyl]methylazanium Openeye Name: [4-[4-(3-benzyloxy-3-oxo-propyl)phenoxy]carbonylcyclohexyl]methylammonium CAS Name: [4-[oxo-[4-(3-oxo-3-phenylmethoxypropyl)phenoxy]methyl]cyclohexyl]methylammonium IUPAC Name: [4-[4-(3-oxo-3-phenylmethoxypropyl)phenoxy]carbonylcyclohexyl]methylazanium Traditional Name: [4-[4-(3-benzoxy-3-keto-propyl)phenoxy]carbonylcyclohexyl]methylammonium Formula: C24H30NO4+ MolecularWeight: 396.4993

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C[NH3+])C(=O)OC2=CC=C(C=C2)CCC(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1CC(CCC1C[NH3+])C(=O)OC2=CC=C(C=C2)CCC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C24H29NO4/c25-16-19-6-11-21(12-7-19)24(27)29-22-13-8-18(9-14-22)10-15-23(26)28-17-20-4-2-1-3-5-20/h1-5,8-9,13-14,19,21H,6-7,10-12,15-17,25H2/p+1