4-tert-butyl-N-[3-(2-morpholin-4-ium-4-ylethylamino)-3-oxidanylidene-propyl]benzamide

Systemtic Name: 4-tert-butyl-N-[3-(2-morpholin-4-ium-4-ylethylamino)-3-oxidanylidene-propyl]benzamide Openeye Name: 4-tert-butyl-N-[3-(2-morpholin-4-ium-4-ylethylamino)-3-oxo-propyl]benzamide CAS Name: 4-tert-butyl-N-[3-[2-(4-morpholin-4-iumyl)ethylamino]-3-oxopropyl]benzamide IUPAC Name: 4-tert-butyl-N-[3-(2-morpholin-4-ium-4-ylethylamino)-3-oxopropyl]benzamide Traditional Name: 4-tert-butyl-N-[3-keto-3-(2-morpholin-4-ium-4-ylethylamino)propyl]benzamide Formula: C20H32N3O3+ MolecularWeight: 362.48638

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NCCC(=O)NCC[NH+]2CCOCC2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NCCC(=O)NCC[NH+]2CCOCC2

InChI

InChI=1S/C20H31N3O3/c1-20(2,3)17-6-4-16(5-7-17)19(25)22-9-8-18(24)21-10-11-23-12-14-26-15-13-23/h4-7H,8-15H2,1-3H3,(H,21,24)(H,22,25)/p+1