4-(2H-benzotriazol-5-ylamino)-7-(2-chloroethyloxy)-6-methoxy-quinoline-3-carbonitrile

Systemtic Name: 4-(2H-benzotriazol-5-ylamino)-7-(2-chloroethyloxy)-6-methoxy-quinoline-3-carbonitrile Openeye Name: 4-(2H-benzotriazol-5-ylamino)-7-(2-chloroethoxy)-6-methoxy-quinoline-3-carbonitrile CAS Name: 4-(2H-benzotriazol-5-ylamino)-7-(2-chloroethoxy)-6-methoxy-3-quinolinecarbonitrile IUPAC Name: 4-(2H-benzotriazol-5-ylamino)-7-(2-chloroethoxy)-6-methoxyquinoline-3-carbonitrile Traditional Name: 4-(2H-benzotriazol-5-ylamino)-7-(2-chloroethoxy)-6-methoxy-quinoline-3-carbonitrile Formula: C19H15ClN6O2 MolecularWeight: 394.8144

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=C(C=N2)C#N)NC3=CC4=NNN=C4C=C3)OCCCl

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=C(C=N2)C#N)NC3=CC4=NNN=C4C=C3)OCCCl

InChI

InChI=1S/C19H15ClN6O2/c1-27-17-7-13-15(8-18(17)28-5-4-20)22-10-11(9-21)19(13)23-12-2-3-14-16(6-12)25-26-24-14/h2-3,6-8,10H,4-5H2,1H3,(H,22,23)(H,24,25,26)