N-(2-methoxy-4-nitro-phenyl)-4-(pyridin-3-ylmethyl)piperazine-1-carboxamide

Systemtic Name: N-(2-methoxy-4-nitro-phenyl)-4-(pyridin-3-ylmethyl)piperazine-1-carboxamide Openeye Name: N-(2-methoxy-4-nitro-phenyl)-4-(3-pyridylmethyl)piperazine-1-carboxamide CAS Name: N-(2-methoxy-4-nitrophenyl)-4-(3-pyridinylmethyl)-1-piperazinecarboxamide IUPAC Name: N-(2-methoxy-4-nitrophenyl)-4-(pyridin-3-ylmethyl)piperazine-1-carboxamide Traditional Name: N-(2-methoxy-4-nitro-phenyl)-4-(3-pyridylmethyl)piperazine-1-carboxamide Formula: C18H21N5O4 MolecularWeight: 371.39044

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)N2CCN(CC2)CC3=CN=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)N2CCN(CC2)CC3=CN=CC=C3

InChI

InChI=1S/C18H21N5O4/c1-27-17-11-15(23(25)26)4-5-16(17)20-18(24)22-9-7-21(8-10-22)13-14-3-2-6-19-12-14/h2-6,11-12H,7-10,13H2,1H3,(H,20,24)