(2S)-N-cyclopentyl-2-[4-(diphenylmethyl)piperazin-1-ium-1-yl]propanamide

Systemtic Name: (2S)-N-cyclopentyl-2-[4-(diphenylmethyl)piperazin-1-ium-1-yl]propanamide Openeye Name: (2S)-2-(4-benzhydrylpiperazin-1-ium-1-yl)-N-cyclopentyl-propanamide CAS Name: (2S)-N-cyclopentyl-2-[4-(diphenylmethyl)-1-piperazin-1-iumyl]propanamide IUPAC Name: (2S)-2-(4-benzhydrylpiperazin-1-ium-1-yl)-N-cyclopentylpropanamide Traditional Name: (2S)-2-(4-benzhydrylpiperazin-1-ium-1-yl)-N-cyclopentyl-propionamide Formula: C25H34N3O+ MolecularWeight: 392.55696

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCC1)[NH+]2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C[C@@H](C(=O)NC1CCCC1)[NH+]2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H33N3O/c1-20(25(29)26-23-14-8-9-15-23)27-16-18-28(19-17-27)24(21-10-4-2-5-11-21)22-12-6-3-7-13-22/h2-7,10-13,20,23-24H,8-9,14-19H2,1H3,(H,26,29)/p+1/t20-/m0/s1