(2R)-N-cycloheptyl-2-[4-[(2-methoxy-5-methyl-phenyl)methyl]piperazin-1-ium-1-yl]propanamide

Systemtic Name: (2R)-N-cycloheptyl-2-[4-[(2-methoxy-5-methyl-phenyl)methyl]piperazin-1-ium-1-yl]propanamide Openeye Name: (2R)-N-cycloheptyl-2-[4-[(2-methoxy-5-methyl-phenyl)methyl]piperazin-1-ium-1-yl]propanamide CAS Name: (2R)-N-cycloheptyl-2-[4-[(2-methoxy-5-methylphenyl)methyl]-1-piperazin-1-iumyl]propanamide IUPAC Name: (2R)-N-cycloheptyl-2-[4-[(2-methoxy-5-methylphenyl)methyl]piperazin-1-ium-1-yl]propanamide Traditional Name: (2R)-N-cycloheptyl-2-[4-(2-methoxy-5-methyl-benzyl)piperazin-1-ium-1-yl]propionamide Formula: C23H38N3O2+ MolecularWeight: 388.56672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)CN2CC[NH+](CC2)C(C)C(=O)NC3CCCCCC3

Isomeric SMILES

CC1=CC(=C(C=C1)OC)CN2CC[NH+](CC2)[C@H](C)C(=O)NC3CCCCCC3

InChI

InChI=1S/C23H37N3O2/c1-18-10-11-22(28-3)20(16-18)17-25-12-14-26(15-13-25)19(2)23(27)24-21-8-6-4-5-7-9-21/h10-11,16,19,21H,4-9,12-15,17H2,1-3H3,(H,24,27)/p+1/t19-/m1/s1