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

Systemtic Name: (2R)-N-aminocarbonyl-2-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-ium-1-yl]propanamide Openeye Name: (2R)-N-carbamoyl-2-[4-[(4-isopropylphenyl)methyl]piperazin-1-ium-1-yl]propanamide CAS Name: (2R)-N-carbamoyl-2-[4-[(4-propan-2-ylphenyl)methyl]-1-piperazin-1-iumyl]propanamide IUPAC Name: (2R)-N-carbamoyl-2-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-ium-1-yl]propanamide Traditional Name: (2R)-N-carbamoyl-2-[4-(4-isopropylbenzyl)piperazin-1-ium-1-yl]propionamide Formula: C18H29N4O2+ MolecularWeight: 333.44846

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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)N

Isomeric SMILES

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

InChI

InChI=1S/C18H28N4O2/c1-13(2)16-6-4-15(5-7-16)12-21-8-10-22(11-9-21)14(3)17(23)20-18(19)24/h4-7,13-14H,8-12H2,1-3H3,(H3,19,20,23,24)/p+1/t14-/m1/s1