3,5-diacetamido-N-[(2R)-2-(2-chlorophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]benzamide

Systemtic Name: 3,5-diacetamido-N-[(2R)-2-(2-chlorophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]benzamide Openeye Name: 3,5-diacetamido-N-[(2R)-2-(2-chlorophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]benzamide CAS Name: 3,5-diacetamido-N-[(2R)-2-(2-chlorophenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]benzamide IUPAC Name: 3,5-diacetamido-N-[(2R)-2-(2-chlorophenyl)-2-pyrrolidin-1-ium-1-ylethyl]benzamide Traditional Name: 3,5-diacetamido-N-[(2R)-2-(2-chlorophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]benzamide Formula: C23H28ClN4O3+ MolecularWeight: 443.94642

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=CC(=C1)C(=O)NCC(C2=CC=CC=C2Cl)[NH+]3CCCC3)NC(=O)C

Isomeric SMILES

CC(=O)NC1=CC(=CC(=C1)C(=O)NC[C@@H](C2=CC=CC=C2Cl)[NH+]3CCCC3)NC(=O)C

InChI

InChI=1S/C23H27ClN4O3/c1-15(29)26-18-11-17(12-19(13-18)27-16(2)30)23(31)25-14-22(28-9-5-6-10-28)20-7-3-4-8-21(20)24/h3-4,7-8,11-13,22H,5-6,9-10,14H2,1-2H3,(H,25,31)(H,26,29)(H,27,30)/p+1/t22-/m0/s1