N-cyclopentyl-4-[(2-propan-2-yloxyphenyl)methyl]piperazin-4-ium-1-carboxamide

Systemtic Name: N-cyclopentyl-4-[(2-propan-2-yloxyphenyl)methyl]piperazin-4-ium-1-carboxamide Openeye Name: N-cyclopentyl-4-[(2-isopropoxyphenyl)methyl]piperazin-4-ium-1-carboxamide CAS Name: N-cyclopentyl-4-[(2-propan-2-yloxyphenyl)methyl]-1-piperazin-4-iumcarboxamide IUPAC Name: N-cyclopentyl-4-[(2-propan-2-yloxyphenyl)methyl]piperazin-4-ium-1-carboxamide Traditional Name: N-cyclopentyl-4-(2-isopropoxybenzyl)piperazin-4-ium-1-carboxamide Formula: C20H32N3O2+ MolecularWeight: 346.48698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC=C1C[NH+]2CCN(CC2)C(=O)NC3CCCC3

Isomeric SMILES

CC(C)OC1=CC=CC=C1C[NH+]2CCN(CC2)C(=O)NC3CCCC3

InChI

InChI=1S/C20H31N3O2/c1-16(2)25-19-10-6-3-7-17(19)15-22-11-13-23(14-12-22)20(24)21-18-8-4-5-9-18/h3,6-7,10,16,18H,4-5,8-9,11-15H2,1-2H3,(H,21,24)/p+1