[(2S)-4-(2-methylpropyl)morpholin-4-ium-2-yl]methyl-[(2S)-4-oxidanylidene-4-phenylazanyl-butan-2-yl]azanium

Systemtic Name: [(2S)-4-(2-methylpropyl)morpholin-4-ium-2-yl]methyl-[(2S)-4-oxidanylidene-4-phenylazanyl-butan-2-yl]azanium Openeye Name: [(1S)-3-anilino-1-methyl-3-oxo-propyl]-[[(2S)-4-isobutylmorpholin-4-ium-2-yl]methyl]ammonium CAS Name: [(2S)-4-anilino-4-oxobutan-2-yl]-[[(2S)-4-(2-methylpropyl)-2-morpholin-4-iumyl]methyl]ammonium IUPAC Name: [(2S)-4-anilino-4-oxobutan-2-yl]-[[(2S)-4-(2-methylpropyl)morpholin-4-ium-2-yl]methyl]azanium Traditional Name: [(1S)-3-anilino-3-keto-1-methyl-propyl]-[[(2S)-4-isobutylmorpholin-4-ium-2-yl]methyl]ammonium Formula: C19H33N3O2+2 MolecularWeight: 335.48422

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[NH+]1CCOC(C1)C[NH2+]C(C)CC(=O)NC2=CC=CC=C2

Isomeric SMILES

C[C@@H](CC(=O)NC1=CC=CC=C1)[NH2+]C[C@H]2C[NH+](CCO2)CC(C)C

InChI

InChI=1S/C19H31N3O2/c1-15(2)13-22-9-10-24-18(14-22)12-20-16(3)11-19(23)21-17-7-5-4-6-8-17/h4-8,15-16,18,20H,9-14H2,1-3H3,(H,21,23)/p+2/t16-,18-/m0/s1