(4-acetamidophenyl)methyl-[[(2R)-4-(2-methylpropyl)morpholin-4-ium-2-yl]methyl]azanium

Systemtic Name: (4-acetamidophenyl)methyl-[[(2R)-4-(2-methylpropyl)morpholin-4-ium-2-yl]methyl]azanium Openeye Name: (4-acetamidophenyl)methyl-[[(2R)-4-isobutylmorpholin-4-ium-2-yl]methyl]ammonium CAS Name: (4-acetamidophenyl)methyl-[[(2R)-4-(2-methylpropyl)-2-morpholin-4-iumyl]methyl]ammonium IUPAC Name: (4-acetamidophenyl)methyl-[[(2R)-4-(2-methylpropyl)morpholin-4-ium-2-yl]methyl]azanium Traditional Name: (4-acetamidobenzyl)-[[(2R)-4-isobutylmorpholin-4-ium-2-yl]methyl]ammonium Formula: C18H31N3O2+2 MolecularWeight: 321.45764

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[NH+]1CCOC(C1)C[NH2+]CC2=CC=C(C=C2)NC(=O)C

Isomeric SMILES

CC(C)C[NH+]1CCO[C@@H](C1)C[NH2+]CC2=CC=C(C=C2)NC(=O)C

InChI

InChI=1S/C18H29N3O2/c1-14(2)12-21-8-9-23-18(13-21)11-19-10-16-4-6-17(7-5-16)20-15(3)22/h4-7,14,18-19H,8-13H2,1-3H3,(H,20,22)/p+2/t18-/m1/s1