ethyl 2-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]carbonylamino]benzoate

Systemtic Name: ethyl 2-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]carbonylamino]benzoate Openeye Name: ethyl 2-[[4-(morpholin-4-ium-4-ylmethyl)benzoyl]amino]benzoate CAS Name: 2-[[[4-(4-morpholin-4-iumylmethyl)phenyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-[[4-(morpholin-4-ium-4-ylmethyl)benzoyl]amino]benzoate Traditional Name: 2-[[4-(morpholin-4-ium-4-ylmethyl)benzoyl]amino]benzoic acid ethyl ester Formula: C21H25N2O4+ MolecularWeight: 369.4342

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1NC(=O)C2=CC=C(C=C2)C[NH+]3CCOCC3

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1NC(=O)C2=CC=C(C=C2)C[NH+]3CCOCC3

InChI

InChI=1S/C21H24N2O4/c1-2-27-21(25)18-5-3-4-6-19(18)22-20(24)17-9-7-16(8-10-17)15-23-11-13-26-14-12-23/h3-10H,2,11-15H2,1H3,(H,22,24)/p+1