N-(3-nitrophenyl)-4-[(2,3,4-trimethoxyphenyl)methyl]piperazine-1-carboxamide

Systemtic Name: N-(3-nitrophenyl)-4-[(2,3,4-trimethoxyphenyl)methyl]piperazine-1-carboxamide Openeye Name: N-(3-nitrophenyl)-4-[(2,3,4-trimethoxyphenyl)methyl]piperazine-1-carboxamide CAS Name: N-(3-nitrophenyl)-4-[(2,3,4-trimethoxyphenyl)methyl]-1-piperazinecarboxamide IUPAC Name: N-(3-nitrophenyl)-4-[(2,3,4-trimethoxyphenyl)methyl]piperazine-1-carboxamide Traditional Name: N-(3-nitrophenyl)-4-(2,3,4-trimethoxybenzyl)piperazine-1-carboxamide Formula: C21H26N4O6 MolecularWeight: 430.45434

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)CN2CCN(CC2)C(=O)NC3=CC(=CC=C3)[N+](=O)[O-])OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)CN2CCN(CC2)C(=O)NC3=CC(=CC=C3)[N+](=O)[O-])OC)OC

InChI

InChI=1S/C21H26N4O6/c1-29-18-8-7-15(19(30-2)20(18)31-3)14-23-9-11-24(12-10-23)21(26)22-16-5-4-6-17(13-16)25(27)28/h4-8,13H,9-12,14H2,1-3H3,(H,22,26)