N-[5-(4-methoxyphenyl)-2-[(3-nitrophenyl)carbonylamino]pyrimidin-4-yl]-3-nitro-benzamide

Systemtic Name: N-[5-(4-methoxyphenyl)-2-[(3-nitrophenyl)carbonylamino]pyrimidin-4-yl]-3-nitro-benzamide Openeye Name: N-[5-(4-methoxyphenyl)-2-[(3-nitrobenzoyl)amino]pyrimidin-4-yl]-3-nitro-benzamide CAS Name: N-[5-(4-methoxyphenyl)-2-[[(3-nitrophenyl)-oxomethyl]amino]-4-pyrimidinyl]-3-nitrobenzamide IUPAC Name: N-[5-(4-methoxyphenyl)-2-[(3-nitrobenzoyl)amino]pyrimidin-4-yl]-3-nitrobenzamide Traditional Name: N-[5-(4-methoxyphenyl)-2-[(3-nitrobenzoyl)amino]pyrimidin-4-yl]-3-nitro-benzamide Formula: C25H18N6O7 MolecularWeight: 514.44642

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CN=C(N=C2NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C2=CN=C(N=C2NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H18N6O7/c1-38-20-10-8-15(9-11-20)21-14-26-25(29-24(33)17-5-3-7-19(13-17)31(36)37)28-22(21)27-23(32)16-4-2-6-18(12-16)30(34)35/h2-14H,1H3,(H2,26,27,28,29,32,33)