4-(3-methylphenoxy)-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]butanamide

Systemtic Name: 4-(3-methylphenoxy)-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]butanamide Openeye Name: 4-(3-methylphenoxy)-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]butanamide CAS Name: 4-(3-methylphenoxy)-N-[[2-(4-morpholin-4-iumylmethyl)phenyl]methyl]butanamide IUPAC Name: 4-(3-methylphenoxy)-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]butanamide Traditional Name: 4-(3-methylphenoxy)-N-[2-(morpholin-4-ium-4-ylmethyl)benzyl]butyramide Formula: C23H31N2O3+ MolecularWeight: 383.50384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCCC(=O)NCC2=CC=CC=C2C[NH+]3CCOCC3

Isomeric SMILES

CC1=CC(=CC=C1)OCCCC(=O)NCC2=CC=CC=C2C[NH+]3CCOCC3

InChI

InChI=1S/C23H30N2O3/c1-19-6-4-9-22(16-19)28-13-5-10-23(26)24-17-20-7-2-3-8-21(20)18-25-11-14-27-15-12-25/h2-4,6-9,16H,5,10-15,17-18H2,1H3,(H,24,26)/p+1