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

Systemtic Name: 2-methyl-N-[3-oxidanylidene-3-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methylamino]propyl]benzamide Openeye Name: 2-methyl-N-[3-oxo-3-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methylamino]propyl]benzamide CAS Name: 2-methyl-N-[3-oxo-3-[[4-(1-pyrrolidin-1-iumylmethyl)phenyl]methylamino]propyl]benzamide IUPAC Name: 2-methyl-N-[3-oxo-3-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methylamino]propyl]benzamide Traditional Name: N-[3-keto-3-[[4-(pyrrolidin-1-ium-1-ylmethyl)benzyl]amino]propyl]-2-methyl-benzamide Formula: C23H30N3O2+ MolecularWeight: 380.5032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NCCC(=O)NCC2=CC=C(C=C2)C[NH+]3CCCC3

Isomeric SMILES

CC1=CC=CC=C1C(=O)NCCC(=O)NCC2=CC=C(C=C2)C[NH+]3CCCC3

InChI

InChI=1S/C23H29N3O2/c1-18-6-2-3-7-21(18)23(28)24-13-12-22(27)25-16-19-8-10-20(11-9-19)17-26-14-4-5-15-26/h2-3,6-11H,4-5,12-17H2,1H3,(H,24,28)(H,25,27)/p+1