2-[(3-methyl-4,5-dihydro-1H-imidazol-3-ium-2-yl)-(2-morpholin-4-ylphenyl)amino]ethyl benzoate

Systemtic Name: 2-[(3-methyl-4,5-dihydro-1H-imidazol-3-ium-2-yl)-(2-morpholin-4-ylphenyl)amino]ethyl benzoate Openeye Name: 2-(N-(3-methyl-4,5-dihydro-1H-imidazol-3-ium-2-yl)-2-morpholino-anilino)ethyl benzoate CAS Name: benzoic acid 2-[N-(3-methyl-4,5-dihydro-1H-imidazol-3-ium-2-yl)-2-(4-morpholinyl)anilino]ethyl ester IUPAC Name: 2-(N-(3-methyl-4,5-dihydro-1H-imidazol-3-ium-2-yl)-2-morpholin-4-ylanilino)ethyl benzoate Traditional Name: benzoic acid 2-(N-(1-methyl-2-imidazolin-1-ium-2-yl)-2-morpholino-anilino)ethyl ester Formula: C23H29N4O3+ MolecularWeight: 409.50136

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(NCC1)N(CCOC(=O)C2=CC=CC=C2)C3=CC=CC=C3N4CCOCC4

Isomeric SMILES

C[N+]1=C(NCC1)N(CCOC(=O)C2=CC=CC=C2)C3=CC=CC=C3N4CCOCC4

InChI

InChI=1S/C23H28N4O3/c1-25-12-11-24-23(25)27(15-18-30-22(28)19-7-3-2-4-8-19)21-10-6-5-9-20(21)26-13-16-29-17-14-26/h2-10H,11-18H2,1H3/p+1