(E)-1-[4-(3-methoxyphenyl)carbonylpiperazin-1-yl]-3-(3-nitrophenyl)prop-2-en-1-one

Systemtic Name: (E)-1-[4-(3-methoxyphenyl)carbonylpiperazin-1-yl]-3-(3-nitrophenyl)prop-2-en-1-one Openeye Name: (E)-1-[4-(3-methoxybenzoyl)piperazin-1-yl]-3-(3-nitrophenyl)prop-2-en-1-one CAS Name: (E)-1-[4-[(3-methoxyphenyl)-oxomethyl]-1-piperazinyl]-3-(3-nitrophenyl)-2-propen-1-one IUPAC Name: (E)-1-[4-(3-methoxybenzoyl)piperazin-1-yl]-3-(3-nitrophenyl)prop-2-en-1-one Traditional Name: (E)-1-(4-m-anisoylpiperazino)-3-(3-nitrophenyl)prop-2-en-1-one Formula: C21H21N3O5 MolecularWeight: 395.40854

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)N2CCN(CC2)C(=O)C=CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)N2CCN(CC2)C(=O)/C=C/C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H21N3O5/c1-29-19-7-3-5-17(15-19)21(26)23-12-10-22(11-13-23)20(25)9-8-16-4-2-6-18(14-16)24(27)28/h2-9,14-15H,10-13H2,1H3/b9-8+