2-acetamidoethyl-[(2R)-4-(1,3-benzodioxol-5-yl)butan-2-yl]azanium

Systemtic Name: 2-acetamidoethyl-[(2R)-4-(1,3-benzodioxol-5-yl)butan-2-yl]azanium Openeye Name: 2-acetamidoethyl-[(1R)-3-(1,3-benzodioxol-5-yl)-1-methyl-propyl]ammonium CAS Name: 2-acetamidoethyl-[(2R)-4-(1,3-benzodioxol-5-yl)butan-2-yl]ammonium IUPAC Name: 2-acetamidoethyl-[(2R)-4-(1,3-benzodioxol-5-yl)butan-2-yl]azanium Traditional Name: 2-acetamidoethyl-[(1R)-3-(1,3-benzodioxol-5-yl)-1-methyl-propyl]ammonium Formula: C15H23N2O3+ MolecularWeight: 279.35472

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC2=C(C=C1)OCO2)[NH2+]CCNC(=O)C

Isomeric SMILES

C[C@H](CCC1=CC2=C(C=C1)OCO2)[NH2+]CCNC(=O)C

InChI

InChI=1S/C15H22N2O3/c1-11(16-7-8-17-12(2)18)3-4-13-5-6-14-15(9-13)20-10-19-14/h5-6,9,11,16H,3-4,7-8,10H2,1-2H3,(H,17,18)/p+1/t11-/m1/s1