2-[4-(phenylmethyl)piperazine-1,4-diium-1-yl]-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]ethanamide

Systemtic Name: 2-[4-(phenylmethyl)piperazine-1,4-diium-1-yl]-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]ethanamide Openeye Name: 2-(4-benzylpiperazine-1,4-diium-1-yl)-N-[(1R)-tetralin-1-yl]acetamide CAS Name: 2-[4-(phenylmethyl)-1-piperazine-1,4-diiumyl]-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide IUPAC Name: 2-(4-benzylpiperazine-1,4-diium-1-yl)-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide Traditional Name: 2-(4-benzylpiperazine-1,4-diium-1-yl)-N-[(1R)-tetralin-1-yl]acetamide Formula: C23H31N3O+2 MolecularWeight: 365.51174

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2=CC=CC=C2C1)NC(=O)C[NH+]3CC[NH+](CC3)CC4=CC=CC=C4

Isomeric SMILES

C1C[C@H](C2=CC=CC=C2C1)NC(=O)C[NH+]3CC[NH+](CC3)CC4=CC=CC=C4

InChI

InChI=1S/C23H29N3O/c27-23(24-22-12-6-10-20-9-4-5-11-21(20)22)18-26-15-13-25(14-16-26)17-19-7-2-1-3-8-19/h1-5,7-9,11,22H,6,10,12-18H2,(H,24,27)/p+2/t22-/m1/s1