N-[(1S)-3-[(1-morpholin-4-ium-4-ylcyclohexyl)methylamino]-3-oxidanylidene-1-phenyl-propyl]benzamide

Systemtic Name: N-[(1S)-3-[(1-morpholin-4-ium-4-ylcyclohexyl)methylamino]-3-oxidanylidene-1-phenyl-propyl]benzamide Openeye Name: N-[(1S)-3-[(1-morpholin-4-ium-4-ylcyclohexyl)methylamino]-3-oxo-1-phenyl-propyl]benzamide CAS Name: N-[(1S)-3-[[1-(4-morpholin-4-iumyl)cyclohexyl]methylamino]-3-oxo-1-phenylpropyl]benzamide IUPAC Name: N-[(1S)-3-[(1-morpholin-4-ium-4-ylcyclohexyl)methylamino]-3-oxo-1-phenylpropyl]benzamide Traditional Name: N-[(1S)-3-keto-3-[(1-morpholin-4-ium-4-ylcyclohexyl)methylamino]-1-phenyl-propyl]benzamide Formula: C27H36N3O3+ MolecularWeight: 450.59304

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CNC(=O)CC(C2=CC=CC=C2)NC(=O)C3=CC=CC=C3)[NH+]4CCOCC4

Isomeric SMILES

C1CCC(CC1)(CNC(=O)C[C@@H](C2=CC=CC=C2)NC(=O)C3=CC=CC=C3)[NH+]4CCOCC4

InChI

InChI=1S/C27H35N3O3/c31-25(28-21-27(14-8-3-9-15-27)30-16-18-33-19-17-30)20-24(22-10-4-1-5-11-22)29-26(32)23-12-6-2-7-13-23/h1-2,4-7,10-13,24H,3,8-9,14-21H2,(H,28,31)(H,29,32)/p+1/t24-/m0/s1