4-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]-3-nitro-N-propan-2-yl-benzamide

Systemtic Name: 4-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]-3-nitro-N-propan-2-yl-benzamide Openeye Name: 4-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]-N-isopropyl-3-nitro-benzamide CAS Name: 4-[4-[(2,5-dimethoxyphenyl)methyl]-1-piperazinyl]-3-nitro-N-propan-2-ylbenzamide IUPAC Name: 4-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]-3-nitro-N-propan-2-ylbenzamide Traditional Name: 4-[4-(2,5-dimethoxybenzyl)piperazino]-N-isopropyl-3-nitro-benzamide Formula: C23H30N4O5 MolecularWeight: 442.5081

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H30N4O5/c1-16(2)24-23(28)17-5-7-20(21(14-17)27(29)30)26-11-9-25(10-12-26)15-18-13-19(31-3)6-8-22(18)32-4/h5-8,13-14,16H,9-12,15H2,1-4H3,(H,24,28)