N-(2-morpholin-4-ium-4-ylethyl)-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide

Systemtic Name: N-(2-morpholin-4-ium-4-ylethyl)-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide Openeye Name: N-(2-morpholin-4-ium-4-ylethyl)-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide CAS Name: N-[2-(4-morpholin-4-iumyl)ethyl]-3-[4-(1-pyrrolidinylsulfonyl)phenyl]propanamide IUPAC Name: N-(2-morpholin-4-ium-4-ylethyl)-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide Traditional Name: N-(2-morpholin-4-ium-4-ylethyl)-3-(4-pyrrolidinosulfonylphenyl)propionamide Formula: C19H30N3O4S+ MolecularWeight: 396.5242

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)NCC[NH+]3CCOCC3

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)NCC[NH+]3CCOCC3

InChI

InChI=1S/C19H29N3O4S/c23-19(20-9-12-21-13-15-26-16-14-21)8-5-17-3-6-18(7-4-17)27(24,25)22-10-1-2-11-22/h3-4,6-7H,1-2,5,8-16H2,(H,20,23)/p+1