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2-acetamidoethyl-[(4-cyanophenyl)methyl]azanium

2-acetamidoethyl-[(4-cyanophenyl)methyl]azanium

Systemtic Name:2-acetamidoethyl-[(4-cyanophenyl)methyl]azanium
Openeye Name:2-acetamidoethyl-[(4-cyanophenyl)methyl]ammonium
CAS Name:2-acetamidoethyl-[(4-cyanophenyl)methyl]ammonium
IUPAC Name:2-acetamidoethyl-[(4-cyanophenyl)methyl]azanium
Traditional Name:2-acetamidoethyl-(4-cyanobenzyl)ammonium
Formula: C12H16N3O+
MolecularWeight: 218.27494
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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC[NH2+]CC1=CC=C(C=C1)C#N


Isomeric SMILES

CC(=O)NCC[NH2+]CC1=CC=C(C=C1)C#N


InChI

InChI=1S/C12H15N3O/c1-10(16)15-7-6-14-9-12-4-2-11(8-13)3-5-12/h2-5,14H,6-7,9H2,1H3,(H,15,16)/p+1


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