(2R)-N-cyclopentyl-2-[4-[(2-methoxy-5-methyl-phenyl)methyl]piperazine-1,4-diium-1-yl]propanamide

Systemtic Name: (2R)-N-cyclopentyl-2-[4-[(2-methoxy-5-methyl-phenyl)methyl]piperazine-1,4-diium-1-yl]propanamide Openeye Name: (2R)-N-cyclopentyl-2-[4-[(2-methoxy-5-methyl-phenyl)methyl]piperazine-1,4-diium-1-yl]propanamide CAS Name: (2R)-N-cyclopentyl-2-[4-[(2-methoxy-5-methylphenyl)methyl]-1-piperazine-1,4-diiumyl]propanamide IUPAC Name: (2R)-N-cyclopentyl-2-[4-[(2-methoxy-5-methylphenyl)methyl]piperazine-1,4-diium-1-yl]propanamide Traditional Name: (2R)-N-cyclopentyl-2-[4-(2-methoxy-5-methyl-benzyl)piperazine-1,4-diium-1-yl]propionamide Formula: C21H35N3O2+2 MolecularWeight: 361.5215

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C[NH+]2CC[NH+](CC2)C(C)C(=O)NC3CCCC3

Isomeric SMILES

CC1=CC(=C(C=C1)OC)C[NH+]2CC[NH+](CC2)[C@H](C)C(=O)NC3CCCC3

InChI

InChI=1S/C21H33N3O2/c1-16-8-9-20(26-3)18(14-16)15-23-10-12-24(13-11-23)17(2)21(25)22-19-6-4-5-7-19/h8-9,14,17,19H,4-7,10-13,15H2,1-3H3,(H,22,25)/p+2/t17-/m1/s1