(2R)-N-naphthalen-2-yl-2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)propanamide

Systemtic Name: (2R)-N-naphthalen-2-yl-2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)propanamide Openeye Name: (2R)-N-(2-naphthyl)-2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)propanamide CAS Name: (2R)-N-(2-naphthalenyl)-2-[4-(2-pyrimidinyl)-1-piperazin-1-iumyl]propanamide IUPAC Name: (2R)-N-naphthalen-2-yl-2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)propanamide Traditional Name: (2R)-N-(2-naphthyl)-2-[4-(2-pyrimidyl)piperazin-1-ium-1-yl]propionamide Formula: C21H24N5O+ MolecularWeight: 362.44816

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=CC=CC=C2C=C1)[NH+]3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

C[C@H](C(=O)NC1=CC2=CC=CC=C2C=C1)[NH+]3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C21H23N5O/c1-16(25-11-13-26(14-12-25)21-22-9-4-10-23-21)20(27)24-19-8-7-17-5-2-3-6-18(17)15-19/h2-10,15-16H,11-14H2,1H3,(H,24,27)/p+1/t16-/m1/s1