2-[1-[(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methyl]piperidin-3-yl]-1,3-benzoxazole

Systemtic Name: 2-[1-[(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methyl]piperidin-3-yl]-1,3-benzoxazole Openeye Name: 2-[1-[(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyl]-3-piperidyl]-1,3-benzoxazole CAS Name: 2-[1-[(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)methyl]-3-piperidinyl]-1,3-benzoxazole IUPAC Name: 2-[1-[(5-chloro-3-methyl-1-phenylpyrazol-4-yl)methyl]piperidin-3-yl]-1,3-benzoxazole Traditional Name: 2-[1-[(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyl]-3-piperidyl]-1,3-benzoxazole Formula: C23H23ClN4O MolecularWeight: 406.90792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1CN2CCCC(C2)C3=NC4=CC=CC=C4O3)Cl)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C(=C1CN2CCCC(C2)C3=NC4=CC=CC=C4O3)Cl)C5=CC=CC=C5

InChI

InChI=1S/C23H23ClN4O/c1-16-19(22(24)28(26-16)18-9-3-2-4-10-18)15-27-13-7-8-17(14-27)23-25-20-11-5-6-12-21(20)29-23/h2-6,9-12,17H,7-8,13-15H2,1H3