2-methoxy-N-[3-oxidanylidene-3-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]amino]propyl]benzamide

Systemtic Name: 2-methoxy-N-[3-oxidanylidene-3-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]amino]propyl]benzamide Openeye Name: 2-methoxy-N-[3-oxo-3-[4-(pyrrolidin-1-ium-1-ylmethyl)anilino]propyl]benzamide CAS Name: 2-methoxy-N-[3-oxo-3-[4-(1-pyrrolidin-1-iumylmethyl)anilino]propyl]benzamide IUPAC Name: 2-methoxy-N-[3-oxo-3-[4-(pyrrolidin-1-ium-1-ylmethyl)anilino]propyl]benzamide Traditional Name: N-[3-keto-3-[4-(pyrrolidin-1-ium-1-ylmethyl)anilino]propyl]-2-methoxy-benzamide Formula: C22H28N3O3+ MolecularWeight: 382.47602

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NCCC(=O)NC2=CC=C(C=C2)C[NH+]3CCCC3

Isomeric SMILES

COC1=CC=CC=C1C(=O)NCCC(=O)NC2=CC=C(C=C2)C[NH+]3CCCC3

InChI

InChI=1S/C22H27N3O3/c1-28-20-7-3-2-6-19(20)22(27)23-13-12-21(26)24-18-10-8-17(9-11-18)16-25-14-4-5-15-25/h2-3,6-11H,4-5,12-16H2,1H3,(H,23,27)(H,24,26)/p+1