N-[(3S)-1-(4-ethoxyphenyl)-5-oxidanylidene-pyrrolidin-3-yl]-4-(2-hydroxyethyl)piperazin-4-ium-1-carboxamide

Systemtic Name: N-[(3S)-1-(4-ethoxyphenyl)-5-oxidanylidene-pyrrolidin-3-yl]-4-(2-hydroxyethyl)piperazin-4-ium-1-carboxamide Openeye Name: N-[(3S)-1-(4-ethoxyphenyl)-5-oxo-pyrrolidin-3-yl]-4-(2-hydroxyethyl)piperazin-4-ium-1-carboxamide CAS Name: N-[(3S)-1-(4-ethoxyphenyl)-5-oxo-3-pyrrolidinyl]-4-(2-hydroxyethyl)-1-piperazin-4-iumcarboxamide IUPAC Name: N-[(3S)-1-(4-ethoxyphenyl)-5-oxopyrrolidin-3-yl]-4-(2-hydroxyethyl)piperazin-4-ium-1-carboxamide Traditional Name: 4-(2-hydroxyethyl)-N-[(3S)-5-keto-1-p-phenetyl-pyrrolidin-3-yl]piperazin-4-ium-1-carboxamide Formula: C19H29N4O4+ MolecularWeight: 377.45796

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2CC(CC2=O)NC(=O)N3CC[NH+](CC3)CCO

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C[C@H](CC2=O)NC(=O)N3CC[NH+](CC3)CCO

InChI

InChI=1S/C19H28N4O4/c1-2-27-17-5-3-16(4-6-17)23-14-15(13-18(23)25)20-19(26)22-9-7-21(8-10-22)11-12-24/h3-6,15,24H,2,7-14H2,1H3,(H,20,26)/p+1/t15-/m0/s1