ethyl 3-[4-[4-(C-ethoxycarbonimidoyl)phenyl]-1,2,3-triazol-1-yl]-4-methoxy-benzenecarboximidate

Systemtic Name: ethyl 3-[4-[4-(C-ethoxycarbonimidoyl)phenyl]-1,2,3-triazol-1-yl]-4-methoxy-benzenecarboximidate Openeye Name: ethyl 3-[4-[4-(ethoxycarbonimidoyl)phenyl]triazol-1-yl]-4-methoxy-benzenecarboximidate CAS Name: 3-[4-[4-[ethoxy(imino)methyl]phenyl]-1-triazolyl]-4-methoxybenzenecarboximidic acid ethyl ester IUPAC Name: ethyl 3-[4-[4-(C-ethoxycarbonimidoyl)phenyl]triazol-1-yl]-4-methoxybenzenecarboximidate Traditional Name: 3-[4-[4-(ethoxycarbonimidoyl)phenyl]triazol-1-yl]-4-methoxy-benzenecarboximidic acid ethyl ester Formula: C21H23N5O3 MolecularWeight: 393.43902

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=N)C1=CC=C(C=C1)C2=CN(N=N2)C3=C(C=CC(=C3)C(=N)OCC)OC

Isomeric SMILES

CCOC(=N)C1=CC=C(C=C1)C2=CN(N=N2)C3=C(C=CC(=C3)C(=N)OCC)OC

InChI

InChI=1S/C21H23N5O3/c1-4-28-20(22)15-8-6-14(7-9-15)17-13-26(25-24-17)18-12-16(21(23)29-5-2)10-11-19(18)27-3/h6-13,22-23H,4-5H2,1-3H3