2-chloranyl-N-[(1S)-3-[[(2R)-3-ethyl-2-morpholin-4-ium-4-yl-pentyl]amino]-3-oxidanylidene-1-phenyl-propyl]benzamide

Systemtic Name: 2-chloranyl-N-[(1S)-3-[[(2R)-3-ethyl-2-morpholin-4-ium-4-yl-pentyl]amino]-3-oxidanylidene-1-phenyl-propyl]benzamide Openeye Name: 2-chloro-N-[(1S)-3-[[(2R)-3-ethyl-2-morpholin-4-ium-4-yl-pentyl]amino]-3-oxo-1-phenyl-propyl]benzamide CAS Name: 2-chloro-N-[(1S)-3-[[(2R)-3-ethyl-2-(4-morpholin-4-iumyl)pentyl]amino]-3-oxo-1-phenylpropyl]benzamide IUPAC Name: 2-chloro-N-[(1S)-3-[[(2R)-3-ethyl-2-morpholin-4-ium-4-ylpentyl]amino]-3-oxo-1-phenylpropyl]benzamide Traditional Name: 2-chloro-N-[(1S)-3-[[(2R)-3-ethyl-2-morpholin-4-ium-4-yl-pentyl]amino]-3-keto-1-phenyl-propyl]benzamide Formula: C27H37ClN3O3+ MolecularWeight: 487.05398

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(CNC(=O)CC(C1=CC=CC=C1)NC(=O)C2=CC=CC=C2Cl)[NH+]3CCOCC3

Isomeric SMILES

CCC(CC)[C@H](CNC(=O)C[C@@H](C1=CC=CC=C1)NC(=O)C2=CC=CC=C2Cl)[NH+]3CCOCC3

InChI

InChI=1S/C27H36ClN3O3/c1-3-20(4-2)25(31-14-16-34-17-15-31)19-29-26(32)18-24(21-10-6-5-7-11-21)30-27(33)22-12-8-9-13-23(22)28/h5-13,20,24-25H,3-4,14-19H2,1-2H3,(H,29,32)(H,30,33)/p+1/t24-,25-/m0/s1