N-(4-methoxy-2-nitro-phenyl)-1-(7-phenylpteridin-4-yl)piperidine-4-carboxamide

Systemtic Name: N-(4-methoxy-2-nitro-phenyl)-1-(7-phenylpteridin-4-yl)piperidine-4-carboxamide Openeye Name: N-(4-methoxy-2-nitro-phenyl)-1-(7-phenylpteridin-4-yl)piperidine-4-carboxamide CAS Name: N-(4-methoxy-2-nitrophenyl)-1-(7-phenyl-4-pteridinyl)-4-piperidinecarboxamide IUPAC Name: N-(4-methoxy-2-nitrophenyl)-1-(7-phenylpteridin-4-yl)piperidine-4-carboxamide Traditional Name: N-(4-methoxy-2-nitro-phenyl)-1-(7-phenylpteridin-4-yl)isonipecotamide Formula: C25H23N7O4 MolecularWeight: 485.49462

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)C2CCN(CC2)C3=NC=NC4=NC(=CN=C43)C5=CC=CC=C5)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)C2CCN(CC2)C3=NC=NC4=NC(=CN=C43)C5=CC=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C25H23N7O4/c1-36-18-7-8-19(21(13-18)32(34)35)30-25(33)17-9-11-31(12-10-17)24-22-23(27-15-28-24)29-20(14-26-22)16-5-3-2-4-6-16/h2-8,13-15,17H,9-12H2,1H3,(H,30,33)