3-azanyl-8-(3,4,5-trimethoxyphenyl)-1,7,8,9-tetrahydro-1,2,4-benzotriazepin-6-one

Systemtic Name: 3-azanyl-8-(3,4,5-trimethoxyphenyl)-1,7,8,9-tetrahydro-1,2,4-benzotriazepin-6-one Openeye Name: 3-amino-8-(3,4,5-trimethoxyphenyl)-1,7,8,9-tetrahydro-1,2,4-benzotriazepin-6-one CAS Name: 3-amino-8-(3,4,5-trimethoxyphenyl)-1,7,8,9-tetrahydro-1,2,4-benzotriazepin-6-one IUPAC Name: 3-amino-8-(3,4,5-trimethoxyphenyl)-1,7,8,9-tetrahydro-1,2,4-benzotriazepin-6-one Traditional Name: 3-amino-8-(3,4,5-trimethoxyphenyl)-1,7,8,9-tetrahydro-1,2,4-benzotriazepin-6-one Formula: C17H20N4O4 MolecularWeight: 344.3651

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2CC3=C(C=NC(=NN3)N)C(=O)C2

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2CC3=C(C=NC(=NN3)N)C(=O)C2

InChI

InChI=1S/C17H20N4O4/c1-23-14-6-10(7-15(24-2)16(14)25-3)9-4-12-11(13(22)5-9)8-19-17(18)21-20-12/h6-9,20H,4-5H2,1-3H3,(H2,18,21)