N-[(2R)-3-methyl-2-morpholin-4-ium-4-yl-butyl]-4-(phenylcarbamoylamino)benzamide

Systemtic Name: N-[(2R)-3-methyl-2-morpholin-4-ium-4-yl-butyl]-4-(phenylcarbamoylamino)benzamide Openeye Name: N-[(2R)-3-methyl-2-morpholin-4-ium-4-yl-butyl]-4-(phenylcarbamoylamino)benzamide CAS Name: 4-[[anilino(oxo)methyl]amino]-N-[(2R)-3-methyl-2-(4-morpholin-4-iumyl)butyl]benzamide IUPAC Name: N-[(2R)-3-methyl-2-morpholin-4-ium-4-ylbutyl]-4-(phenylcarbamoylamino)benzamide Traditional Name: N-[(2R)-3-methyl-2-morpholin-4-ium-4-yl-butyl]-4-(phenylcarbamoylamino)benzamide Formula: C23H31N4O3+ MolecularWeight: 411.51724

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CNC(=O)C1=CC=C(C=C1)NC(=O)NC2=CC=CC=C2)[NH+]3CCOCC3

Isomeric SMILES

CC(C)[C@H](CNC(=O)C1=CC=C(C=C1)NC(=O)NC2=CC=CC=C2)[NH+]3CCOCC3

InChI

InChI=1S/C23H30N4O3/c1-17(2)21(27-12-14-30-15-13-27)16-24-22(28)18-8-10-20(11-9-18)26-23(29)25-19-6-4-3-5-7-19/h3-11,17,21H,12-16H2,1-2H3,(H,24,28)(H2,25,26,29)/p+1/t21-/m0/s1