2-[4-[4-(phenylcarbamoylamino)phenyl]carbonylpiperazin-1-ium-1-yl]-N-propan-2-yl-ethanamide

Systemtic Name: 2-[4-[4-(phenylcarbamoylamino)phenyl]carbonylpiperazin-1-ium-1-yl]-N-propan-2-yl-ethanamide Openeye Name: N-isopropyl-2-[4-[4-(phenylcarbamoylamino)benzoyl]piperazin-1-ium-1-yl]acetamide CAS Name: 2-[4-[[4-[[anilino(oxo)methyl]amino]phenyl]-oxomethyl]-1-piperazin-1-iumyl]-N-propan-2-ylacetamide IUPAC Name: 2-[4-[4-(phenylcarbamoylamino)benzoyl]piperazin-1-ium-1-yl]-N-propan-2-ylacetamide Traditional Name: N-isopropyl-2-[4-[4-(phenylcarbamoylamino)benzoyl]piperazin-1-ium-1-yl]acetamide Formula: C23H30N5O3+ MolecularWeight: 424.516

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C[NH+]1CCN(CC1)C(=O)C2=CC=C(C=C2)NC(=O)NC3=CC=CC=C3

Isomeric SMILES

CC(C)NC(=O)C[NH+]1CCN(CC1)C(=O)C2=CC=C(C=C2)NC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C23H29N5O3/c1-17(2)24-21(29)16-27-12-14-28(15-13-27)22(30)18-8-10-20(11-9-18)26-23(31)25-19-6-4-3-5-7-19/h3-11,17H,12-16H2,1-2H3,(H,24,29)(H2,25,26,31)/p+1