(2-cyclopropyl-1,3-benzoxazol-6-yl)-[4-[(3-methylpyridin-2-yl)methyl]piperazin-4-ium-1-yl]methanone

Systemtic Name: (2-cyclopropyl-1,3-benzoxazol-6-yl)-[4-[(3-methylpyridin-2-yl)methyl]piperazin-4-ium-1-yl]methanone Openeye Name: (2-cyclopropyl-1,3-benzoxazol-6-yl)-[4-[(3-methyl-2-pyridyl)methyl]piperazin-4-ium-1-yl]methanone CAS Name: (2-cyclopropyl-1,3-benzoxazol-6-yl)-[4-[(3-methyl-2-pyridinyl)methyl]-1-piperazin-4-iumyl]methanone IUPAC Name: (2-cyclopropyl-1,3-benzoxazol-6-yl)-[4-[(3-methylpyridin-2-yl)methyl]piperazin-4-ium-1-yl]methanone Traditional Name: (2-cyclopropyl-1,3-benzoxazol-6-yl)-[4-[(3-methyl-2-pyridyl)methyl]piperazin-4-ium-1-yl]methanone Formula: C22H25N4O2+ MolecularWeight: 377.4595

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC=C1)C[NH+]2CCN(CC2)C(=O)C3=CC4=C(C=C3)N=C(O4)C5CC5

Isomeric SMILES

CC1=C(N=CC=C1)C[NH+]2CCN(CC2)C(=O)C3=CC4=C(C=C3)N=C(O4)C5CC5

InChI

InChI=1S/C22H24N4O2/c1-15-3-2-8-23-19(15)14-25-9-11-26(12-10-25)22(27)17-6-7-18-20(13-17)28-21(24-18)16-4-5-16/h2-3,6-8,13,16H,4-5,9-12,14H2,1H3/p+1