(4-aminocarbonylphenyl)methyl-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-methyl-azanium

Systemtic Name: (4-aminocarbonylphenyl)methyl-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-methyl-azanium Openeye Name: (4-carbamoylphenyl)methyl-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-methyl-ammonium CAS Name: (4-carbamoylphenyl)methyl-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-methylammonium IUPAC Name: (4-carbamoylphenyl)methyl-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-methylazanium Traditional Name: (4-carbamoylbenzyl)-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-methyl-ammonium Formula: C18H21N2O3+ MolecularWeight: 313.37094

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)C(=O)N)CC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)C(=O)N)CC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C18H20N2O3/c1-20(11-13-2-5-15(6-3-13)18(19)21)12-14-4-7-16-17(10-14)23-9-8-22-16/h2-7,10H,8-9,11-12H2,1H3,(H2,19,21)/p+1