8-[[5-nitro-2-[(3,4,5-trimethoxyphenyl)amino]pyrimidin-4-yl]amino]-3,4-dihydro-2H-naphthalen-1-one

Systemtic Name: 8-[[5-nitro-2-[(3,4,5-trimethoxyphenyl)amino]pyrimidin-4-yl]amino]-3,4-dihydro-2H-naphthalen-1-one Openeye Name: 8-[[5-nitro-2-(3,4,5-trimethoxyanilino)pyrimidin-4-yl]amino]tetralin-1-one CAS Name: 8-[[5-nitro-2-(3,4,5-trimethoxyanilino)-4-pyrimidinyl]amino]-3,4-dihydro-2H-naphthalen-1-one IUPAC Name: 8-[[5-nitro-2-(3,4,5-trimethoxyanilino)pyrimidin-4-yl]amino]-3,4-dihydro-2H-naphthalen-1-one Traditional Name: 8-[[5-nitro-2-(3,4,5-trimethoxyanilino)pyrimidin-4-yl]amino]tetralin-1-one Formula: C23H23N5O6 MolecularWeight: 465.45862

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC2=NC=C(C(=N2)NC3=CC=CC4=C3C(=O)CCC4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC2=NC=C(C(=N2)NC3=CC=CC4=C3C(=O)CCC4)[N+](=O)[O-]

InChI

InChI=1S/C23H23N5O6/c1-32-18-10-14(11-19(33-2)21(18)34-3)25-23-24-12-16(28(30)31)22(27-23)26-15-8-4-6-13-7-5-9-17(29)20(13)15/h4,6,8,10-12H,5,7,9H2,1-3H3,(H2,24,25,26,27)