N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[4-(4-nitrophenyl)piperazin-1-yl]propanamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[4-(4-nitrophenyl)piperazin-1-yl]propanamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[4-(4-nitrophenyl)piperazin-1-yl]propanamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[4-(4-nitrophenyl)-1-piperazinyl]propanamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[4-(4-nitrophenyl)piperazin-1-yl]propanamide Traditional Name: N-homoveratryl-2-[4-(4-nitrophenyl)piperazino]propionamide Formula: C23H30N4O5 MolecularWeight: 442.5081

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCC1=CC(=C(C=C1)OC)OC)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)NCCC1=CC(=C(C=C1)OC)OC)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H30N4O5/c1-17(23(28)24-11-10-18-4-9-21(31-2)22(16-18)32-3)25-12-14-26(15-13-25)19-5-7-20(8-6-19)27(29)30/h4-9,16-17H,10-15H2,1-3H3,(H,24,28)