[4-[4-nitro-3-(phenethylamino)phenyl]piperazin-1-yl]-(4-propan-2-yloxyphenyl)methanone

Systemtic Name: [4-[4-nitro-3-(phenethylamino)phenyl]piperazin-1-yl]-(4-propan-2-yloxyphenyl)methanone Openeye Name: (4-isopropoxyphenyl)-[4-[4-nitro-3-(phenethylamino)phenyl]piperazin-1-yl]methanone CAS Name: [4-[4-nitro-3-(phenethylamino)phenyl]-1-piperazinyl]-(4-propan-2-yloxyphenyl)methanone IUPAC Name: [4-[4-nitro-3-(phenethylamino)phenyl]piperazin-1-yl]-(4-propan-2-yloxyphenyl)methanone Traditional Name: (4-isopropoxyphenyl)-[4-[4-nitro-3-(phenethylamino)phenyl]piperazino]methanone Formula: C28H32N4O4 MolecularWeight: 488.57808

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC(=C(C=C3)[N+](=O)[O-])NCCC4=CC=CC=C4

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC(=C(C=C3)[N+](=O)[O-])NCCC4=CC=CC=C4

InChI

InChI=1S/C28H32N4O4/c1-21(2)36-25-11-8-23(9-12-25)28(33)31-18-16-30(17-19-31)24-10-13-27(32(34)35)26(20-24)29-15-14-22-6-4-3-5-7-22/h3-13,20-21,29H,14-19H2,1-2H3