2-[[(E)-(3-morpholin-4-ylpropylamino)methylideneamino]methylamino]benzoic acid

Systemtic Name: 2-[[(E)-(3-morpholin-4-ylpropylamino)methylideneamino]methylamino]benzoic acid Openeye Name: 2-[[(E)-(3-morpholinopropylamino)methyleneamino]methylamino]benzoic acid CAS Name: 2-[[(E)-[3-(4-morpholinyl)propylamino]methylideneamino]methylamino]benzoic acid IUPAC Name: 2-[[(E)-(3-morpholin-4-ylpropylamino)methylideneamino]methylamino]benzoic acid Traditional Name: 2-[[(E)-(3-morpholinopropylamino)methyleneamino]methylamino]benzoic acid Formula: C16H24N4O3 MolecularWeight: 320.38676

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCNC=NCNC2=CC=CC=C2C(=O)O

Isomeric SMILES

C1COCCN1CCCN/C=N/CNC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C16H24N4O3/c21-16(22)14-4-1-2-5-15(14)19-13-18-12-17-6-3-7-20-8-10-23-11-9-20/h1-2,4-5,12,19H,3,6-11,13H2,(H,17,18)(H,21,22)