4-(2-azanyl-2-oxidanylidene-ethoxy)-3,5-dimethoxy-N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide

Systemtic Name: 4-(2-azanyl-2-oxidanylidene-ethoxy)-3,5-dimethoxy-N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide Openeye Name: 4-(2-amino-2-oxo-ethoxy)-3,5-dimethoxy-N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide CAS Name: 4-(2-amino-2-oxoethoxy)-3,5-dimethoxy-N-[[4-(1-pyrrolidin-1-iumylmethyl)phenyl]methyl]benzamide IUPAC Name: 4-(2-amino-2-oxoethoxy)-3,5-dimethoxy-N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide Traditional Name: 4-(2-amino-2-keto-ethoxy)-3,5-dimethoxy-N-[4-(pyrrolidin-1-ium-1-ylmethyl)benzyl]benzamide Formula: C23H30N3O5+ MolecularWeight: 428.5014

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OCC(=O)N)OC)C(=O)NCC2=CC=C(C=C2)C[NH+]3CCCC3

Isomeric SMILES

COC1=CC(=CC(=C1OCC(=O)N)OC)C(=O)NCC2=CC=C(C=C2)C[NH+]3CCCC3

InChI

InChI=1S/C23H29N3O5/c1-29-19-11-18(12-20(30-2)22(19)31-15-21(24)27)23(28)25-13-16-5-7-17(8-6-16)14-26-9-3-4-10-26/h5-8,11-12H,3-4,9-10,13-15H2,1-2H3,(H2,24,27)(H,25,28)/p+1