3-[3-(1,3-benzodioxol-5-ylcarbamoyl)phenoxy]propylazanium

Systemtic Name: 3-[3-(1,3-benzodioxol-5-ylcarbamoyl)phenoxy]propylazanium Openeye Name: 3-[3-(1,3-benzodioxol-5-ylcarbamoyl)phenoxy]propylammonium CAS Name: 3-[3-[(1,3-benzodioxol-5-ylamino)-oxomethyl]phenoxy]propylammonium IUPAC Name: 3-[3-(1,3-benzodioxol-5-ylcarbamoyl)phenoxy]propylazanium Traditional Name: 3-[3-(1,3-benzodioxol-5-ylcarbamoyl)phenoxy]propylammonium Formula: C17H19N2O4+ MolecularWeight: 315.34376

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=O)C3=CC(=CC=C3)OCCC[NH3+]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=O)C3=CC(=CC=C3)OCCC[NH3+]

InChI

InChI=1S/C17H18N2O4/c18-7-2-8-21-14-4-1-3-12(9-14)17(20)19-13-5-6-15-16(10-13)23-11-22-15/h1,3-6,9-10H,2,7-8,11,18H2,(H,19,20)/p+1