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

Systemtic Name: N-[(1R)-1-cyclopropylethyl]-2-[4-(phenylmethyl)piperazine-1,4-diium-1-yl]ethanamide Openeye Name: 2-(4-benzylpiperazine-1,4-diium-1-yl)-N-[(1R)-1-cyclopropylethyl]acetamide CAS Name: N-[(1R)-1-cyclopropylethyl]-2-[4-(phenylmethyl)-1-piperazine-1,4-diiumyl]acetamide IUPAC Name: 2-(4-benzylpiperazine-1,4-diium-1-yl)-N-[(1R)-1-cyclopropylethyl]acetamide Traditional Name: 2-(4-benzylpiperazine-1,4-diium-1-yl)-N-[(1R)-1-cyclopropylethyl]acetamide Formula: C18H29N3O+2 MolecularWeight: 303.44236

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CC1)NC(=O)C[NH+]2CC[NH+](CC2)CC3=CC=CC=C3

Isomeric SMILES

C[C@H](C1CC1)NC(=O)C[NH+]2CC[NH+](CC2)CC3=CC=CC=C3

InChI

InChI=1S/C18H27N3O/c1-15(17-7-8-17)19-18(22)14-21-11-9-20(10-12-21)13-16-5-3-2-4-6-16/h2-6,15,17H,7-14H2,1H3,(H,19,22)/p+2/t15-/m1/s1