2-(benzotriazol-1-yl)-3-piperazin-1-yl-naphthalene-1,4-dione

Systemtic Name: 2-(benzotriazol-1-yl)-3-piperazin-1-yl-naphthalene-1,4-dione Openeye Name: 2-(benzotriazol-1-yl)-3-piperazin-1-yl-naphthalene-1,4-dione CAS Name: 2-(1-benzotriazolyl)-3-(1-piperazinyl)naphthalene-1,4-dione IUPAC Name: 2-(benzotriazol-1-yl)-3-piperazin-1-ylnaphthalene-1,4-dione Traditional Name: 2-(benzotriazol-1-yl)-3-piperazino-1,4-naphthoquinone Formula: C20H17N5O2 MolecularWeight: 359.38128

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=C(C(=O)C3=CC=CC=C3C2=O)N4C5=CC=CC=C5N=N4

Isomeric SMILES

C1CN(CCN1)C2=C(C(=O)C3=CC=CC=C3C2=O)N4C5=CC=CC=C5N=N4

InChI

InChI=1S/C20H17N5O2/c26-19-13-5-1-2-6-14(13)20(27)18(17(19)24-11-9-21-10-12-24)25-16-8-4-3-7-15(16)22-23-25/h1-8,21H,9-12H2