ethyl 3-[4-(3-methoxyphenyl)carbonylpiperazin-1-yl]carbonyl-5-nitro-benzoate

Systemtic Name: ethyl 3-[4-(3-methoxyphenyl)carbonylpiperazin-1-yl]carbonyl-5-nitro-benzoate Openeye Name: ethyl 3-[4-(3-methoxybenzoyl)piperazine-1-carbonyl]-5-nitro-benzoate CAS Name: 3-[[4-[(3-methoxyphenyl)-oxomethyl]-1-piperazinyl]-oxomethyl]-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-[4-(3-methoxybenzoyl)piperazine-1-carbonyl]-5-nitrobenzoate Traditional Name: 3-(4-m-anisoylpiperazine-1-carbonyl)-5-nitro-benzoic acid ethyl ester Formula: C22H23N3O7 MolecularWeight: 441.43392

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23N3O7/c1-3-32-22(28)17-11-16(12-18(13-17)25(29)30)21(27)24-9-7-23(8-10-24)20(26)15-5-4-6-19(14-15)31-2/h4-6,11-14H,3,7-10H2,1-2H3