(3R)-N-[(2S)-2-(4-fluorophenyl)-2-morpholin-4-ium-4-yl-ethyl]-3-imidazol-1-yl-butanamide

Systemtic Name: (3R)-N-[(2S)-2-(4-fluorophenyl)-2-morpholin-4-ium-4-yl-ethyl]-3-imidazol-1-yl-butanamide Openeye Name: (3R)-N-[(2S)-2-(4-fluorophenyl)-2-morpholin-4-ium-4-yl-ethyl]-3-imidazol-1-yl-butanamide CAS Name: (3R)-N-[(2S)-2-(4-fluorophenyl)-2-(4-morpholin-4-iumyl)ethyl]-3-(1-imidazolyl)butanamide IUPAC Name: (3R)-N-[(2S)-2-(4-fluorophenyl)-2-morpholin-4-ium-4-ylethyl]-3-imidazol-1-ylbutanamide Traditional Name: (3R)-N-[(2S)-2-(4-fluorophenyl)-2-morpholin-4-ium-4-yl-ethyl]-3-imidazol-1-yl-butyramide Formula: C19H26FN4O2+ MolecularWeight: 361.433743

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)NCC(C1=CC=C(C=C1)F)[NH+]2CCOCC2)N3C=CN=C3

Isomeric SMILES

C[C@H](CC(=O)NC[C@H](C1=CC=C(C=C1)F)[NH+]2CCOCC2)N3C=CN=C3

InChI

InChI=1S/C19H25FN4O2/c1-15(24-7-6-21-14-24)12-19(25)22-13-18(23-8-10-26-11-9-23)16-2-4-17(20)5-3-16/h2-7,14-15,18H,8-13H2,1H3,(H,22,25)/p+1/t15-,18-/m1/s1