2-morpholin-4-ium-4-yl-5-[(4-phenylphenyl)methylamino]benzoate

Systemtic Name: 2-morpholin-4-ium-4-yl-5-[(4-phenylphenyl)methylamino]benzoate Openeye Name: 2-morpholin-4-ium-4-yl-5-[(4-phenylphenyl)methylamino]benzoate CAS Name: 2-(4-morpholin-4-iumyl)-5-[(4-phenylphenyl)methylamino]benzoate IUPAC Name: 2-morpholin-4-ium-4-yl-5-[(4-phenylphenyl)methylamino]benzoate Traditional Name: 2-morpholin-4-ium-4-yl-5-[(4-phenylbenzyl)amino]benzoate Formula: C24H24N2O3 MolecularWeight: 388.45896

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1C2=C(C=C(C=C2)NCC3=CC=C(C=C3)C4=CC=CC=C4)C(=O)[O-]

Isomeric SMILES

C1COCC[NH+]1C2=C(C=C(C=C2)NCC3=CC=C(C=C3)C4=CC=CC=C4)C(=O)[O-]

InChI

InChI=1S/C24H24N2O3/c27-24(28)22-16-21(10-11-23(22)26-12-14-29-15-13-26)25-17-18-6-8-20(9-7-18)19-4-2-1-3-5-19/h1-11,16,25H,12-15,17H2,(H,27,28)