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

Systemtic Name: methyl 2-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]carbonylamino]benzoate Openeye Name: methyl 2-[[4-(morpholin-4-ium-4-ylmethyl)benzoyl]amino]benzoate CAS Name: 2-[[[4-(4-morpholin-4-iumylmethyl)phenyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[4-(morpholin-4-ium-4-ylmethyl)benzoyl]amino]benzoate Traditional Name: 2-[[4-(morpholin-4-ium-4-ylmethyl)benzoyl]amino]benzoic acid methyl ester Formula: C20H23N2O4+ MolecularWeight: 355.40762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N2O4/c1-25-20(24)17-4-2-3-5-18(17)21-19(23)16-8-6-15(7-9-16)14-22-10-12-26-13-11-22/h2-9H,10-14H2,1H3,(H,21,23)/p+1