methyl 4-methyl-3-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]carbonylamino]benzoate

Systemtic Name: methyl 4-methyl-3-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]carbonylamino]benzoate Openeye Name: methyl 4-methyl-3-[[4-(morpholin-4-ium-4-ylmethyl)benzoyl]amino]benzoate CAS Name: 4-methyl-3-[[[4-(4-morpholin-4-iumylmethyl)phenyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[[4-(morpholin-4-ium-4-ylmethyl)benzoyl]amino]benzoate Traditional Name: 4-methyl-3-[[4-(morpholin-4-ium-4-ylmethyl)benzoyl]amino]benzoic acid methyl ester Formula: C21H25N2O4+ MolecularWeight: 369.4342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C2=CC=C(C=C2)C[NH+]3CCOCC3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C2=CC=C(C=C2)C[NH+]3CCOCC3

InChI

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