(2S)-2-[4-(diphenylmethyl)piperazine-1,4-diium-1-yl]-N-(propan-2-ylcarbamoyl)propanamide

Systemtic Name: (2S)-2-[4-(diphenylmethyl)piperazine-1,4-diium-1-yl]-N-(propan-2-ylcarbamoyl)propanamide Openeye Name: (2S)-2-(4-benzhydrylpiperazine-1,4-diium-1-yl)-N-(isopropylcarbamoyl)propanamide CAS Name: (2S)-2-[4-(diphenylmethyl)-1-piperazine-1,4-diiumyl]-N-[oxo-(propan-2-ylamino)methyl]propanamide IUPAC Name: (2S)-2-(4-benzhydrylpiperazine-1,4-diium-1-yl)-N-(propan-2-ylcarbamoyl)propanamide Traditional Name: (2S)-2-(4-benzhydrylpiperazine-1,4-diium-1-yl)-N-(isopropylcarbamoyl)propionamide Formula: C24H34N4O2+2 MolecularWeight: 410.55236

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC(=O)C(C)[NH+]1CC[NH+](CC1)C(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

C[C@@H](C(=O)NC(=O)NC(C)C)[NH+]1CC[NH+](CC1)C(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C24H32N4O2/c1-18(2)25-24(30)26-23(29)19(3)27-14-16-28(17-15-27)22(20-10-6-4-7-11-20)21-12-8-5-9-13-21/h4-13,18-19,22H,14-17H2,1-3H3,(H2,25,26,29,30)/p+2/t19-/m0/s1