1-(1,3-benzodioxol-5-yl)-3-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]urea

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]urea Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]urea CAS Name: 1-(1,3-benzodioxol-5-yl)-3-[[4-(4-morpholin-4-iumylmethyl)phenyl]methyl]urea IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]urea Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-[4-(morpholin-4-ium-4-ylmethyl)benzyl]urea Formula: C20H24N3O4+ MolecularWeight: 370.42226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=CC=C(C=C2)CNC(=O)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1COCC[NH+]1CC2=CC=C(C=C2)CNC(=O)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H23N3O4/c24-20(22-17-5-6-18-19(11-17)27-14-26-18)21-12-15-1-3-16(4-2-15)13-23-7-9-25-10-8-23/h1-6,11H,7-10,12-14H2,(H2,21,22,24)/p+1