dimethyl-[(1R)-2-[[4-oxidanylidene-4-(4-propoxyphenyl)butanoyl]amino]-1-phenyl-ethyl]azanium

Systemtic Name: dimethyl-[(1R)-2-[[4-oxidanylidene-4-(4-propoxyphenyl)butanoyl]amino]-1-phenyl-ethyl]azanium Openeye Name: dimethyl-[(1R)-2-[[4-oxo-4-(4-propoxyphenyl)butanoyl]amino]-1-phenyl-ethyl]ammonium CAS Name: [(1R)-2-[[1,4-dioxo-4-(4-propoxyphenyl)butyl]amino]-1-phenylethyl]-dimethylammonium IUPAC Name: dimethyl-[(1R)-2-[[4-oxo-4-(4-propoxyphenyl)butanoyl]amino]-1-phenylethyl]azanium Traditional Name: [(1R)-2-[[4-keto-4-(4-propoxyphenyl)butanoyl]amino]-1-phenyl-ethyl]-dimethyl-ammonium Formula: C23H31N2O3+ MolecularWeight: 383.50384

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)CCC(=O)NCC(C2=CC=CC=C2)[NH+](C)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)CCC(=O)NC[C@@H](C2=CC=CC=C2)[NH+](C)C

InChI

InChI=1S/C23H30N2O3/c1-4-16-28-20-12-10-19(11-13-20)22(26)14-15-23(27)24-17-21(25(2)3)18-8-6-5-7-9-18/h5-13,21H,4,14-17H2,1-3H3,(H,24,27)/p+1/t21-/m0/s1