N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ium-4-yl-ethyl]-4-(2-oxidanylidene-1,3-benzoxazol-3-yl)butanamide

Systemtic Name: N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ium-4-yl-ethyl]-4-(2-oxidanylidene-1,3-benzoxazol-3-yl)butanamide Openeye Name: N-[(1R)-2-morpholin-4-ium-4-yl-1-(p-tolyl)ethyl]-4-(2-oxo-1,3-benzoxazol-3-yl)butanamide CAS Name: N-[(1R)-1-(4-methylphenyl)-2-(4-morpholin-4-iumyl)ethyl]-4-(2-oxo-1,3-benzoxazol-3-yl)butanamide IUPAC Name: N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ium-4-ylethyl]-4-(2-oxo-1,3-benzoxazol-3-yl)butanamide Traditional Name: 4-(2-keto-1,3-benzoxazol-3-yl)-N-[(1R)-2-morpholin-4-ium-4-yl-1-(p-tolyl)ethyl]butyramide Formula: C24H30N3O4+ MolecularWeight: 424.5127

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C[NH+]2CCOCC2)NC(=O)CCCN3C4=CC=CC=C4OC3=O

Isomeric SMILES

CC1=CC=C(C=C1)[C@H](C[NH+]2CCOCC2)NC(=O)CCCN3C4=CC=CC=C4OC3=O

InChI

InChI=1S/C24H29N3O4/c1-18-8-10-19(11-9-18)20(17-26-13-15-30-16-14-26)25-23(28)7-4-12-27-21-5-2-3-6-22(21)31-24(27)29/h2-3,5-6,8-11,20H,4,7,12-17H2,1H3,(H,25,28)/p+1/t20-/m0/s1