[4-(3-morpholin-4-yl-4-nitro-phenyl)piperazin-1-yl]-(3,4,5-triethoxyphenyl)methanone

Systemtic Name: [4-(3-morpholin-4-yl-4-nitro-phenyl)piperazin-1-yl]-(3,4,5-triethoxyphenyl)methanone Openeye Name: [4-(3-morpholino-4-nitro-phenyl)piperazin-1-yl]-(3,4,5-triethoxyphenyl)methanone CAS Name: [4-[3-(4-morpholinyl)-4-nitrophenyl]-1-piperazinyl]-(3,4,5-triethoxyphenyl)methanone IUPAC Name: [4-(3-morpholin-4-yl-4-nitrophenyl)piperazin-1-yl]-(3,4,5-triethoxyphenyl)methanone Traditional Name: [4-(3-morpholino-4-nitro-phenyl)piperazino]-(3,4,5-triethoxyphenyl)methanone Formula: C27H36N4O7 MolecularWeight: 528.59734

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)N2CCN(CC2)C3=CC(=C(C=C3)[N+](=O)[O-])N4CCOCC4

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)N2CCN(CC2)C3=CC(=C(C=C3)[N+](=O)[O-])N4CCOCC4

InChI

InChI=1S/C27H36N4O7/c1-4-36-24-17-20(18-25(37-5-2)26(24)38-6-3)27(32)30-11-9-28(10-12-30)21-7-8-22(31(33)34)23(19-21)29-13-15-35-16-14-29/h7-8,17-19H,4-6,9-16H2,1-3H3