(2R)-N-(methylcarbamoyl)-2-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-ium-1-yl]propanamide

Systemtic Name: (2R)-N-(methylcarbamoyl)-2-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-ium-1-yl]propanamide Openeye Name: (2R)-2-[4-[(4-isopropylphenyl)methyl]piperazin-1-ium-1-yl]-N-(methylcarbamoyl)propanamide CAS Name: (2R)-N-(methylcarbamoyl)-2-[4-[(4-propan-2-ylphenyl)methyl]-1-piperazin-1-iumyl]propanamide IUPAC Name: (2R)-N-(methylcarbamoyl)-2-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-ium-1-yl]propanamide Traditional Name: (2R)-2-[4-(4-isopropylbenzyl)piperazin-1-ium-1-yl]-N-(methylcarbamoyl)propionamide Formula: C19H31N4O2+ MolecularWeight: 347.47504

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CN2CC[NH+](CC2)C(C)C(=O)NC(=O)NC

Isomeric SMILES

C[C@H](C(=O)NC(=O)NC)[NH+]1CCN(CC1)CC2=CC=C(C=C2)C(C)C

InChI

InChI=1S/C19H30N4O2/c1-14(2)17-7-5-16(6-8-17)13-22-9-11-23(12-10-22)15(3)18(24)21-19(25)20-4/h5-8,14-15H,9-13H2,1-4H3,(H2,20,21,24,25)/p+1/t15-/m1/s1