N-[2,5-diethoxy-4-(2-pyrrolidin-1-ium-1-ylethanoylamino)phenyl]benzamide

Systemtic Name: N-[2,5-diethoxy-4-(2-pyrrolidin-1-ium-1-ylethanoylamino)phenyl]benzamide Openeye Name: N-[2,5-diethoxy-4-[(2-pyrrolidin-1-ium-1-ylacetyl)amino]phenyl]benzamide CAS Name: N-[2,5-diethoxy-4-[[1-oxo-2-(1-pyrrolidin-1-iumyl)ethyl]amino]phenyl]benzamide IUPAC Name: N-[2,5-diethoxy-4-[(2-pyrrolidin-1-ium-1-ylacetyl)amino]phenyl]benzamide Traditional Name: N-[2,5-diethoxy-4-[(2-pyrrolidin-1-ium-1-ylacetyl)amino]phenyl]benzamide Formula: C23H30N3O4+ MolecularWeight: 412.502

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1NC(=O)C2=CC=CC=C2)OCC)NC(=O)C[NH+]3CCCC3

Isomeric SMILES

CCOC1=CC(=C(C=C1NC(=O)C2=CC=CC=C2)OCC)NC(=O)C[NH+]3CCCC3

InChI

InChI=1S/C23H29N3O4/c1-3-29-20-15-19(25-23(28)17-10-6-5-7-11-17)21(30-4-2)14-18(20)24-22(27)16-26-12-8-9-13-26/h5-7,10-11,14-15H,3-4,8-9,12-13,16H2,1-2H3,(H,24,27)(H,25,28)/p+1