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

Systemtic Name: N-[(2R)-2-(3-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3-[(4-methoxyphenyl)sulfonylamino]propanamide Openeye Name: N-[(2R)-2-(3-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3-[(4-methoxyphenyl)sulfonylamino]propanamide CAS Name: N-[(2R)-2-(3-methoxyphenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-3-[(4-methoxyphenyl)sulfonylamino]propanamide IUPAC Name: N-[(2R)-2-(3-methoxyphenyl)-2-pyrrolidin-1-ium-1-ylethyl]-3-[(4-methoxyphenyl)sulfonylamino]propanamide Traditional Name: N-[(2R)-2-(3-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3-[(4-methoxyphenyl)sulfonylamino]propionamide Formula: C23H32N3O5S+ MolecularWeight: 462.58228

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H31N3O5S/c1-30-19-8-10-21(11-9-19)32(28,29)25-13-12-23(27)24-17-22(26-14-3-4-15-26)18-6-5-7-20(16-18)31-2/h5-11,16,22,25H,3-4,12-15,17H2,1-2H3,(H,24,27)/p+1/t22-/m0/s1