3-azanyl-4-(3-morpholin-4-ium-4-ylpropylamino)benzoate

Systemtic Name: 3-azanyl-4-(3-morpholin-4-ium-4-ylpropylamino)benzoate Openeye Name: 3-amino-4-(3-morpholin-4-ium-4-ylpropylamino)benzoate CAS Name: 3-amino-4-[3-(4-morpholin-4-iumyl)propylamino]benzoate IUPAC Name: 3-amino-4-(3-morpholin-4-ium-4-ylpropylamino)benzoate Traditional Name: 3-amino-4-(3-morpholin-4-ium-4-ylpropylamino)benzoate Formula: C14H21N3O3 MolecularWeight: 279.33484

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCNC2=C(C=C(C=C2)C(=O)[O-])N

Isomeric SMILES

C1COCC[NH+]1CCCNC2=C(C=C(C=C2)C(=O)[O-])N

InChI

InChI=1S/C14H21N3O3/c15-12-10-11(14(18)19)2-3-13(12)16-4-1-5-17-6-8-20-9-7-17/h2-3,10,16H,1,4-9,15H2,(H,18,19)