methyl N-[(E)-[5-chloranyl-3-methyl-1-(phenylmethyl)pyrazol-4-yl]methylideneamino]carbamate

Systemtic Name: methyl N-[(E)-[5-chloranyl-3-methyl-1-(phenylmethyl)pyrazol-4-yl]methylideneamino]carbamate Openeye Name: methyl N-[(E)-(1-benzyl-5-chloro-3-methyl-pyrazol-4-yl)methyleneamino]carbamate CAS Name: N-[(E)-[5-chloro-3-methyl-1-(phenylmethyl)-4-pyrazolyl]methylideneamino]carbamic acid methyl ester IUPAC Name: methyl N-[(E)-(1-benzyl-5-chloro-3-methylpyrazol-4-yl)methylideneamino]carbamate Traditional Name: N-[(E)-(1-benzyl-5-chloro-3-methyl-pyrazol-4-yl)methyleneamino]carbamic acid methyl ester Formula: C14H15ClN4O2 MolecularWeight: 306.7475

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=NNC(=O)OC)Cl)CC2=CC=CC=C2

Isomeric SMILES

CC1=NN(C(=C1/C=N/NC(=O)OC)Cl)CC2=CC=CC=C2

InChI

InChI=1S/C14H15ClN4O2/c1-10-12(8-16-17-14(20)21-2)13(15)19(18-10)9-11-6-4-3-5-7-11/h3-8H,9H2,1-2H3,(H,17,20)/b16-8+