2-[4-[3-(1H-indol-3-yl)propanoyl]piperazin-1-ium-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)ethanamide

Systemtic Name: 2-[4-[3-(1H-indol-3-yl)propanoyl]piperazin-1-ium-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)ethanamide Openeye Name: 2-[4-[3-(1H-indol-3-yl)propanoyl]piperazin-1-ium-1-yl]-N-(5-methylisoxazol-3-yl)acetamide CAS Name: 2-[4-[3-(1H-indol-3-yl)-1-oxopropyl]-1-piperazin-1-iumyl]-N-(5-methyl-3-isoxazolyl)acetamide IUPAC Name: 2-[4-[3-(1H-indol-3-yl)propanoyl]piperazin-1-ium-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide Traditional Name: 2-[4-[3-(1H-indol-3-yl)propanoyl]piperazin-1-ium-1-yl]-N-(5-methylisoxazol-3-yl)acetamide Formula: C21H26N5O3+ MolecularWeight: 396.46284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)C[NH+]2CCN(CC2)C(=O)CCC3=CNC4=CC=CC=C43

Isomeric SMILES

CC1=CC(=NO1)NC(=O)C[NH+]2CCN(CC2)C(=O)CCC3=CNC4=CC=CC=C43

InChI

InChI=1S/C21H25N5O3/c1-15-12-19(24-29-15)23-20(27)14-25-8-10-26(11-9-25)21(28)7-6-16-13-22-18-5-3-2-4-17(16)18/h2-5,12-13,22H,6-11,14H2,1H3,(H,23,24,27)/p+1