N-(3-nitrophenyl)-4-[(4-propan-2-ylphenyl)methyl]piperazine-1-carboxamide

Systemtic Name: N-(3-nitrophenyl)-4-[(4-propan-2-ylphenyl)methyl]piperazine-1-carboxamide Openeye Name: 4-[(4-isopropylphenyl)methyl]-N-(3-nitrophenyl)piperazine-1-carboxamide CAS Name: N-(3-nitrophenyl)-4-[(4-propan-2-ylphenyl)methyl]-1-piperazinecarboxamide IUPAC Name: N-(3-nitrophenyl)-4-[(4-propan-2-ylphenyl)methyl]piperazine-1-carboxamide Traditional Name: 4-(4-isopropylbenzyl)-N-(3-nitrophenyl)piperazine-1-carboxamide Formula: C21H26N4O3 MolecularWeight: 382.45614

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N4O3/c1-16(2)18-8-6-17(7-9-18)15-23-10-12-24(13-11-23)21(26)22-19-4-3-5-20(14-19)25(27)28/h3-9,14,16H,10-13,15H2,1-2H3,(H,22,26)