N-[2-[4-[(4-propan-2-ylphenyl)methyl]piperazine-1,4-diium-1-yl]ethyl]ethanamide

Systemtic Name: N-[2-[4-[(4-propan-2-ylphenyl)methyl]piperazine-1,4-diium-1-yl]ethyl]ethanamide Openeye Name: N-[2-[4-[(4-isopropylphenyl)methyl]piperazine-1,4-diium-1-yl]ethyl]acetamide CAS Name: N-[2-[4-[(4-propan-2-ylphenyl)methyl]-1-piperazine-1,4-diiumyl]ethyl]acetamide IUPAC Name: N-[2-[4-[(4-propan-2-ylphenyl)methyl]piperazine-1,4-diium-1-yl]ethyl]acetamide Traditional Name: N-[2-[4-(4-isopropylbenzyl)piperazine-1,4-diium-1-yl]ethyl]acetamide Formula: C18H31N3O+2 MolecularWeight: 305.45824

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C[NH+]2CC[NH+](CC2)CCNC(=O)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C[NH+]2CC[NH+](CC2)CCNC(=O)C

InChI

InChI=1S/C18H29N3O/c1-15(2)18-6-4-17(5-7-18)14-21-12-10-20(11-13-21)9-8-19-16(3)22/h4-7,15H,8-14H2,1-3H3,(H,19,22)/p+2