1-[[(3R)-1-(1,3-benzodioxol-5-yl)-5-oxidanylidene-pyrrolidin-3-yl]methyl]-3-phenethyl-urea

Systemtic Name: 1-[[(3R)-1-(1,3-benzodioxol-5-yl)-5-oxidanylidene-pyrrolidin-3-yl]methyl]-3-phenethyl-urea Openeye Name: 1-[[(3R)-1-(1,3-benzodioxol-5-yl)-5-oxo-pyrrolidin-3-yl]methyl]-3-phenethyl-urea CAS Name: 1-[[(3R)-1-(1,3-benzodioxol-5-yl)-5-oxo-3-pyrrolidinyl]methyl]-3-phenethylurea IUPAC Name: 1-[[(3R)-1-(1,3-benzodioxol-5-yl)-5-oxopyrrolidin-3-yl]methyl]-3-phenethylurea Traditional Name: 1-[[(3R)-1-(1,3-benzodioxol-5-yl)-5-keto-pyrrolidin-3-yl]methyl]-3-phenethyl-urea Formula: C21H23N3O4 MolecularWeight: 381.42502

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1=O)C2=CC3=C(C=C2)OCO3)CNC(=O)NCCC4=CC=CC=C4

Isomeric SMILES

C1[C@@H](CN(C1=O)C2=CC3=C(C=C2)OCO3)CNC(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C21H23N3O4/c25-20-10-16(12-23-21(26)22-9-8-15-4-2-1-3-5-15)13-24(20)17-6-7-18-19(11-17)28-14-27-18/h1-7,11,16H,8-10,12-14H2,(H2,22,23,26)/t16-/m1/s1