1-(3-nitro-4-phenylmethoxy-phenyl)-2-[(phenylmethyl)-propan-2-yl-amino]ethanone

Systemtic Name: 1-(3-nitro-4-phenylmethoxy-phenyl)-2-[(phenylmethyl)-propan-2-yl-amino]ethanone Openeye Name: 2-[benzyl(isopropyl)amino]-1-(4-benzyloxy-3-nitro-phenyl)ethanone CAS Name: 1-(3-nitro-4-phenylmethoxyphenyl)-2-[(phenylmethyl)-propan-2-ylamino]ethanone IUPAC Name: 2-[benzyl(propan-2-yl)amino]-1-(3-nitro-4-phenylmethoxyphenyl)ethanone Traditional Name: 1-(4-benzoxy-3-nitro-phenyl)-2-[benzyl(isopropyl)amino]ethanone Formula: C25H26N2O4 MolecularWeight: 418.48494

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=CC=CC=C1)CC(=O)C2=CC(=C(C=C2)OCC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)N(CC1=CC=CC=C1)CC(=O)C2=CC(=C(C=C2)OCC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C25H26N2O4/c1-19(2)26(16-20-9-5-3-6-10-20)17-24(28)22-13-14-25(23(15-22)27(29)30)31-18-21-11-7-4-8-12-21/h3-15,19H,16-18H2,1-2H3