4-(morpholin-4-ium-4-ylmethyl)-N-[(E)-4-phenylbutan-2-ylideneamino]benzamide

Systemtic Name: 4-(morpholin-4-ium-4-ylmethyl)-N-[(E)-4-phenylbutan-2-ylideneamino]benzamide Openeye Name: N-[(E)-(1-methyl-3-phenyl-propylidene)amino]-4-(morpholin-4-ium-4-ylmethyl)benzamide CAS Name: 4-(4-morpholin-4-iumylmethyl)-N-[(E)-4-phenylbutan-2-ylideneamino]benzamide IUPAC Name: 4-(morpholin-4-ium-4-ylmethyl)-N-[(E)-4-phenylbutan-2-ylideneamino]benzamide Traditional Name: N-[(E)-(1-methyl-3-phenyl-propylidene)amino]-4-(morpholin-4-ium-4-ylmethyl)benzamide Formula: C22H28N3O2+ MolecularWeight: 366.47662

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC=C(C=C1)C[NH+]2CCOCC2)CCC3=CC=CC=C3

Isomeric SMILES

C/C(=N\NC(=O)C1=CC=C(C=C1)C[NH+]2CCOCC2)/CCC3=CC=CC=C3

InChI

InChI=1S/C22H27N3O2/c1-18(7-8-19-5-3-2-4-6-19)23-24-22(26)21-11-9-20(10-12-21)17-25-13-15-27-16-14-25/h2-6,9-12H,7-8,13-17H2,1H3,(H,24,26)/p+1/b23-18+