[4-[[(1S)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]amino]-3-nitro-phenyl]-phenyl-methanone

Systemtic Name: [4-[[(1S)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]amino]-3-nitro-phenyl]-phenyl-methanone Openeye Name: [4-[[(1S)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]amino]-3-nitro-phenyl]-phenyl-methanone CAS Name: [4-[[(1S)-2-(4-morpholin-4-iumyl)-1-phenylethyl]amino]-3-nitrophenyl]-phenylmethanone IUPAC Name: [4-[[(1S)-2-morpholin-4-ium-4-yl-1-phenylethyl]amino]-3-nitrophenyl]-phenylmethanone Traditional Name: [4-[[(1S)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]amino]-3-nitro-phenyl]-phenyl-methanone Formula: C25H26N3O4+ MolecularWeight: 432.49164

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC(C2=CC=CC=C2)NC3=C(C=C(C=C3)C(=O)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1COCC[NH+]1C[C@H](C2=CC=CC=C2)NC3=C(C=C(C=C3)C(=O)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H25N3O4/c29-25(20-9-5-2-6-10-20)21-11-12-22(24(17-21)28(30)31)26-23(19-7-3-1-4-8-19)18-27-13-15-32-16-14-27/h1-12,17,23,26H,13-16,18H2/p+1/t23-/m1/s1