[4-[[2-(furan-2-ylmethyl)-3-oxidanyl-propyl]amino]-3-nitro-phenyl]-phenyl-methanone

Systemtic Name: [4-[[2-(furan-2-ylmethyl)-3-oxidanyl-propyl]amino]-3-nitro-phenyl]-phenyl-methanone Openeye Name: [4-[[2-(2-furylmethyl)-3-hydroxy-propyl]amino]-3-nitro-phenyl]-phenyl-methanone CAS Name: [4-[[2-(2-furanylmethyl)-3-hydroxypropyl]amino]-3-nitrophenyl]-phenylmethanone IUPAC Name: [4-[[2-(furan-2-ylmethyl)-3-hydroxypropyl]amino]-3-nitrophenyl]-phenylmethanone Traditional Name: [4-[[2-(2-furfuryl)-3-hydroxy-propyl]amino]-3-nitro-phenyl]-phenyl-methanone Formula: C21H20N2O5 MolecularWeight: 380.3939

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=CC(=C(C=C2)NCC(CC3=CC=CO3)CO)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=CC(=C(C=C2)NCC(CC3=CC=CO3)CO)[N+](=O)[O-]

InChI

InChI=1S/C21H20N2O5/c24-14-15(11-18-7-4-10-28-18)13-22-19-9-8-17(12-20(19)23(26)27)21(25)16-5-2-1-3-6-16/h1-10,12,15,22,24H,11,13-14H2