N-[(E)-(3-methoxy-4-phenylmethoxy-phenyl)methylideneamino]-1H-1,2,4-triazole-5-carboxamide

Systemtic Name: N-[(E)-(3-methoxy-4-phenylmethoxy-phenyl)methylideneamino]-1H-1,2,4-triazole-5-carboxamide Openeye Name: N-[(E)-(4-benzyloxy-3-methoxy-phenyl)methyleneamino]-1H-1,2,4-triazole-5-carboxamide CAS Name: N-[(E)-(3-methoxy-4-phenylmethoxyphenyl)methylideneamino]-1H-1,2,4-triazole-5-carboxamide IUPAC Name: N-[(E)-(3-methoxy-4-phenylmethoxyphenyl)methylideneamino]-1H-1,2,4-triazole-5-carboxamide Traditional Name: N-[(E)-(4-benzoxy-3-methoxy-benzylidene)amino]-1H-1,2,4-triazole-5-carboxamide Formula: C18H17N5O3 MolecularWeight: 351.35928

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=NNC(=O)C2=NC=NN2)OCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)/C=N/NC(=O)C2=NC=NN2)OCC3=CC=CC=C3

InChI

InChI=1S/C18H17N5O3/c1-25-16-9-14(10-20-23-18(24)17-19-12-21-22-17)7-8-15(16)26-11-13-5-3-2-4-6-13/h2-10,12H,11H2,1H3,(H,23,24)(H,19,21,22)/b20-10+