N-[(2R)-2-(2-chlorophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3-[(4-methoxyphenyl)carbamoylamino]propanamide

Systemtic Name: N-[(2R)-2-(2-chlorophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3-[(4-methoxyphenyl)carbamoylamino]propanamide Openeye Name: N-[(2R)-2-(2-chlorophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3-[(4-methoxyphenyl)carbamoylamino]propanamide CAS Name: N-[(2R)-2-(2-chlorophenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-3-[[(4-methoxyanilino)-oxomethyl]amino]propanamide IUPAC Name: N-[(2R)-2-(2-chlorophenyl)-2-pyrrolidin-1-ium-1-ylethyl]-3-[(4-methoxyphenyl)carbamoylamino]propanamide Traditional Name: N-[(2R)-2-(2-chlorophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3-[(4-methoxyphenyl)carbamoylamino]propionamide Formula: C23H30ClN4O3+ MolecularWeight: 445.9623

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)NCCC(=O)NCC(C2=CC=CC=C2Cl)[NH+]3CCCC3

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)NCCC(=O)NC[C@@H](C2=CC=CC=C2Cl)[NH+]3CCCC3

InChI

InChI=1S/C23H29ClN4O3/c1-31-18-10-8-17(9-11-18)27-23(30)25-13-12-22(29)26-16-21(28-14-4-5-15-28)19-6-2-3-7-20(19)24/h2-3,6-11,21H,4-5,12-16H2,1H3,(H,26,29)(H2,25,27,30)/p+1/t21-/m0/s1