N-[[(2S)-butan-2-yl]carbamoyl]-2-[4-(2-phenoxyethyl)piperazine-1,4-diium-1-yl]ethanamide

Systemtic Name: N-[[(2S)-butan-2-yl]carbamoyl]-2-[4-(2-phenoxyethyl)piperazine-1,4-diium-1-yl]ethanamide Openeye Name: N-[[(1S)-1-methylpropyl]carbamoyl]-2-[4-(2-phenoxyethyl)piperazine-1,4-diium-1-yl]acetamide CAS Name: N-[[[(2S)-butan-2-yl]amino]-oxomethyl]-2-[4-(2-phenoxyethyl)-1-piperazine-1,4-diiumyl]acetamide IUPAC Name: N-[[(2S)-butan-2-yl]carbamoyl]-2-[4-(2-phenoxyethyl)piperazine-1,4-diium-1-yl]acetamide Traditional Name: N-[[(1S)-1-methylpropyl]carbamoyl]-2-[4-(2-phenoxyethyl)piperazine-1,4-diium-1-yl]acetamide Formula: C19H32N4O3+2 MolecularWeight: 364.48238

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)NC(=O)C[NH+]1CC[NH+](CC1)CCOC2=CC=CC=C2

Isomeric SMILES

CC[C@H](C)NC(=O)NC(=O)C[NH+]1CC[NH+](CC1)CCOC2=CC=CC=C2

InChI

InChI=1S/C19H30N4O3/c1-3-16(2)20-19(25)21-18(24)15-23-11-9-22(10-12-23)13-14-26-17-7-5-4-6-8-17/h4-8,16H,3,9-15H2,1-2H3,(H2,20,21,24,25)/p+2/t16-/m0/s1