N-[(2R)-2-(4-fluorophenyl)-2-morpholin-4-ium-4-yl-ethyl]-4-(phenylcarbamoylamino)benzamide

Systemtic Name: N-[(2R)-2-(4-fluorophenyl)-2-morpholin-4-ium-4-yl-ethyl]-4-(phenylcarbamoylamino)benzamide Openeye Name: N-[(2R)-2-(4-fluorophenyl)-2-morpholin-4-ium-4-yl-ethyl]-4-(phenylcarbamoylamino)benzamide CAS Name: 4-[[anilino(oxo)methyl]amino]-N-[(2R)-2-(4-fluorophenyl)-2-(4-morpholin-4-iumyl)ethyl]benzamide IUPAC Name: N-[(2R)-2-(4-fluorophenyl)-2-morpholin-4-ium-4-ylethyl]-4-(phenylcarbamoylamino)benzamide Traditional Name: N-[(2R)-2-(4-fluorophenyl)-2-morpholin-4-ium-4-yl-ethyl]-4-(phenylcarbamoylamino)benzamide Formula: C26H28FN4O3+ MolecularWeight: 463.523923

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1C(CNC(=O)C2=CC=C(C=C2)NC(=O)NC3=CC=CC=C3)C4=CC=C(C=C4)F

Isomeric SMILES

C1COCC[NH+]1[C@@H](CNC(=O)C2=CC=C(C=C2)NC(=O)NC3=CC=CC=C3)C4=CC=C(C=C4)F

InChI

InChI=1S/C26H27FN4O3/c27-21-10-6-19(7-11-21)24(31-14-16-34-17-15-31)18-28-25(32)20-8-12-23(13-9-20)30-26(33)29-22-4-2-1-3-5-22/h1-13,24H,14-18H2,(H,28,32)(H2,29,30,33)/p+1/t24-/m0/s1