1-[4-(4-hydroxyphenyl)carbonylpiperazin-1-yl]-3-(4-nitrophenoxy)propan-1-one

Systemtic Name: 1-[4-(4-hydroxyphenyl)carbonylpiperazin-1-yl]-3-(4-nitrophenoxy)propan-1-one Openeye Name: 1-[4-(4-hydroxybenzoyl)piperazin-1-yl]-3-(4-nitrophenoxy)propan-1-one CAS Name: 1-[4-[(4-hydroxyphenyl)-oxomethyl]-1-piperazinyl]-3-(4-nitrophenoxy)-1-propanone IUPAC Name: 1-[4-(4-hydroxybenzoyl)piperazin-1-yl]-3-(4-nitrophenoxy)propan-1-one Traditional Name: 1-[4-(4-hydroxybenzoyl)piperazino]-3-(4-nitrophenoxy)propan-1-one Formula: C20H21N3O6 MolecularWeight: 399.39724

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCOC2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=C(C=C3)O

Isomeric SMILES

C1CN(CCN1C(=O)CCOC2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=C(C=C3)O

InChI

InChI=1S/C20H21N3O6/c24-17-5-1-15(2-6-17)20(26)22-12-10-21(11-13-22)19(25)9-14-29-18-7-3-16(4-8-18)23(27)28/h1-8,24H,9-14H2