4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]-N-(4-nitrophenyl)piperidine-1-carboxamide

Systemtic Name: 4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]-N-(4-nitrophenyl)piperidine-1-carboxamide Openeye Name: 4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]-N-(4-nitrophenyl)piperidine-1-carboxamide CAS Name: 4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]-N-(4-nitrophenyl)-1-piperidinecarboxamide IUPAC Name: 4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]-N-(4-nitrophenyl)piperidine-1-carboxamide Traditional Name: 4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]-N-(4-nitrophenyl)piperidine-1-carboxamide Formula: C20H23N7O3 MolecularWeight: 409.44172

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1N(C)C2=NC=NC3=C2C=CN3)C(=O)NC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1N(C)C2=NC=NC3=C2C=CN3)C(=O)NC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H23N7O3/c1-13-8-10-26(20(28)24-14-3-5-15(6-4-14)27(29)30)11-17(13)25(2)19-16-7-9-21-18(16)22-12-23-19/h3-7,9,12-13,17H,8,10-11H2,1-2H3,(H,24,28)(H,21,22,23)