(2R)-N-cyclopropyl-2-[4-[(3-methylphenyl)methyl]piperazine-1,4-diium-1-yl]propanamide

Systemtic Name: (2R)-N-cyclopropyl-2-[4-[(3-methylphenyl)methyl]piperazine-1,4-diium-1-yl]propanamide Openeye Name: (2R)-N-cyclopropyl-2-[4-(m-tolylmethyl)piperazine-1,4-diium-1-yl]propanamide CAS Name: (2R)-N-cyclopropyl-2-[4-[(3-methylphenyl)methyl]-1-piperazine-1,4-diiumyl]propanamide IUPAC Name: (2R)-N-cyclopropyl-2-[4-[(3-methylphenyl)methyl]piperazine-1,4-diium-1-yl]propanamide Traditional Name: (2R)-N-cyclopropyl-2-[4-(3-methylbenzyl)piperazine-1,4-diium-1-yl]propionamide Formula: C18H29N3O+2 MolecularWeight: 303.44236

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C[NH+]2CC[NH+](CC2)C(C)C(=O)NC3CC3

Isomeric SMILES

CC1=CC(=CC=C1)C[NH+]2CC[NH+](CC2)[C@H](C)C(=O)NC3CC3

InChI

InChI=1S/C18H27N3O/c1-14-4-3-5-16(12-14)13-20-8-10-21(11-9-20)15(2)18(22)19-17-6-7-17/h3-5,12,15,17H,6-11,13H2,1-2H3,(H,19,22)/p+2/t15-/m1/s1