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

Systemtic Name: methyl 2-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]carbamoylamino]benzoate Openeye Name: methyl 2-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]carbamoylamino]benzoate CAS Name: 2-[[[4-(4-morpholin-4-iumylmethyl)anilino]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]carbamoylamino]benzoate Traditional Name: 2-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]carbamoylamino]benzoic acid methyl ester Formula: C20H24N3O4+ MolecularWeight: 370.42226

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)NC2=CC=C(C=C2)C[NH+]3CCOCC3

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)NC2=CC=C(C=C2)C[NH+]3CCOCC3

InChI

InChI=1S/C20H23N3O4/c1-26-19(24)17-4-2-3-5-18(17)22-20(25)21-16-8-6-15(7-9-16)14-23-10-12-27-13-11-23/h2-9H,10-14H2,1H3,(H2,21,22,25)/p+1