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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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