(2R)-2-(4-methylpiperazine-1,4-diium-1-yl)-N-[(phenylmethyl)carbamoyl]propanamide

Systemtic Name: (2R)-2-(4-methylpiperazine-1,4-diium-1-yl)-N-[(phenylmethyl)carbamoyl]propanamide Openeye Name: (2R)-N-(benzylcarbamoyl)-2-(4-methylpiperazine-1,4-diium-1-yl)propanamide CAS Name: (2R)-2-(4-methyl-1-piperazine-1,4-diiumyl)-N-[oxo-[(phenylmethyl)amino]methyl]propanamide IUPAC Name: (2R)-N-(benzylcarbamoyl)-2-(4-methylpiperazine-1,4-diium-1-yl)propanamide Traditional Name: (2R)-N-(benzylcarbamoyl)-2-(4-methylpiperazine-1,4-diium-1-yl)propionamide Formula: C16H26N4O2+2 MolecularWeight: 306.40324

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NCC1=CC=CC=C1)[NH+]2CC[NH+](CC2)C

Isomeric SMILES

C[C@H](C(=O)NC(=O)NCC1=CC=CC=C1)[NH+]2CC[NH+](CC2)C

InChI

InChI=1S/C16H24N4O2/c1-13(20-10-8-19(2)9-11-20)15(21)18-16(22)17-12-14-6-4-3-5-7-14/h3-7,13H,8-12H2,1-2H3,(H2,17,18,21,22)/p+2/t13-/m1/s1