2-acetamidoethyl-[(1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]azanium

Systemtic Name: 2-acetamidoethyl-[(1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]azanium Openeye Name: 2-acetamidoethyl-[(1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]ammonium CAS Name: 2-acetamidoethyl-[(1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]ammonium IUPAC Name: 2-acetamidoethyl-[(1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]azanium Traditional Name: 2-acetamidoethyl-[(1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]ammonium Formula: C15H23N2O3+ MolecularWeight: 279.35472

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCCCO2)[NH2+]CCNC(=O)C

Isomeric SMILES

C[C@@H](C1=CC2=C(C=C1)OCCCO2)[NH2+]CCNC(=O)C

InChI

InChI=1S/C15H22N2O3/c1-11(16-6-7-17-12(2)18)13-4-5-14-15(10-13)20-9-3-8-19-14/h4-5,10-11,16H,3,6-9H2,1-2H3,(H,17,18)/p+1/t11-/m0/s1