piperazin-4-ium-1-yl-[5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2-oxazol-3-yl]methanone

Systemtic Name: piperazin-4-ium-1-yl-[5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2-oxazol-3-yl]methanone Openeye Name: piperazin-4-ium-1-yl-(5-tetralin-6-ylisoxazol-3-yl)methanone CAS Name: 1-piperazin-4-iumyl-[5-(5,6,7,8-tetrahydronaphthalen-2-yl)-3-isoxazolyl]methanone IUPAC Name: piperazin-4-ium-1-yl-[5-(5,6,7,8-tetrahydronaphthalen-2-yl)-1,2-oxazol-3-yl]methanone Traditional Name: piperazin-4-ium-1-yl-(5-tetralin-6-ylisoxazol-3-yl)methanone Formula: C18H22N3O2+ MolecularWeight: 312.38618

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=CC(=C2)C3=CC(=NO3)C(=O)N4CC[NH2+]CC4

Isomeric SMILES

C1CCC2=C(C1)C=CC(=C2)C3=CC(=NO3)C(=O)N4CC[NH2+]CC4

InChI

InChI=1S/C18H21N3O2/c22-18(21-9-7-19-8-10-21)16-12-17(23-20-16)15-6-5-13-3-1-2-4-14(13)11-15/h5-6,11-12,19H,1-4,7-10H2/p+1