[4-[4-nitro-3-[[(1R)-1-phenylethyl]amino]phenyl]piperazin-1-yl]-phenyl-methanone

Systemtic Name: [4-[4-nitro-3-[[(1R)-1-phenylethyl]amino]phenyl]piperazin-1-yl]-phenyl-methanone Openeye Name: [4-[4-nitro-3-[[(1R)-1-phenylethyl]amino]phenyl]piperazin-1-yl]-phenyl-methanone CAS Name: [4-[4-nitro-3-[[(1R)-1-phenylethyl]amino]phenyl]-1-piperazinyl]-phenylmethanone IUPAC Name: [4-[4-nitro-3-[[(1R)-1-phenylethyl]amino]phenyl]piperazin-1-yl]-phenylmethanone Traditional Name: [4-[4-nitro-3-[[(1R)-1-phenylethyl]amino]phenyl]piperazino]-phenyl-methanone Formula: C25H26N4O3 MolecularWeight: 430.49894

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC2=C(C=CC(=C2)N3CCN(CC3)C(=O)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C[C@H](C1=CC=CC=C1)NC2=C(C=CC(=C2)N3CCN(CC3)C(=O)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H26N4O3/c1-19(20-8-4-2-5-9-20)26-23-18-22(12-13-24(23)29(31)32)27-14-16-28(17-15-27)25(30)21-10-6-3-7-11-21/h2-13,18-19,26H,14-17H2,1H3/t19-/m1/s1