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

Systemtic Name: 2-(benzotriazol-1-yl)-3-(3-morpholin-4-ylpropylamino)naphthalene-1,4-dione Openeye Name: 2-(benzotriazol-1-yl)-3-(3-morpholinopropylamino)naphthalene-1,4-dione CAS Name: 2-(1-benzotriazolyl)-3-[3-(4-morpholinyl)propylamino]naphthalene-1,4-dione IUPAC Name: 2-(benzotriazol-1-yl)-3-(3-morpholin-4-ylpropylamino)naphthalene-1,4-dione Traditional Name: 2-(benzotriazol-1-yl)-3-(3-morpholinopropylamino)-1,4-naphthoquinone Formula: C23H23N5O3 MolecularWeight: 417.46042

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCNC2=C(C(=O)C3=CC=CC=C3C2=O)N4C5=CC=CC=C5N=N4

Isomeric SMILES

C1COCCN1CCCNC2=C(C(=O)C3=CC=CC=C3C2=O)N4C5=CC=CC=C5N=N4

InChI

InChI=1S/C23H23N5O3/c29-22-16-6-1-2-7-17(16)23(30)21(28-19-9-4-3-8-18(19)25-26-28)20(22)24-10-5-11-27-12-14-31-15-13-27/h1-4,6-9,24H,5,10-15H2