4-nitro-N-[2-oxidanyl-5-[1-oxidanyl-2-(propan-2-ylamino)ethyl]phenyl]benzamide

Systemtic Name: 4-nitro-N-[2-oxidanyl-5-[1-oxidanyl-2-(propan-2-ylamino)ethyl]phenyl]benzamide Openeye Name: N-[2-hydroxy-5-[1-hydroxy-2-(isopropylamino)ethyl]phenyl]-4-nitro-benzamide CAS Name: N-[2-hydroxy-5-[1-hydroxy-2-(propan-2-ylamino)ethyl]phenyl]-4-nitrobenzamide IUPAC Name: N-[2-hydroxy-5-[1-hydroxy-2-(propan-2-ylamino)ethyl]phenyl]-4-nitrobenzamide Traditional Name: N-[2-hydroxy-5-[1-hydroxy-2-(isopropylamino)ethyl]phenyl]-4-nitro-benzamide Formula: C18H21N3O5 MolecularWeight: 359.37644

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCC(C1=CC(=C(C=C1)O)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])O

Isomeric SMILES

CC(C)NCC(C1=CC(=C(C=C1)O)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])O

InChI

InChI=1S/C18H21N3O5/c1-11(2)19-10-17(23)13-5-8-16(22)15(9-13)20-18(24)12-3-6-14(7-4-12)21(25)26/h3-9,11,17,19,22-23H,10H2,1-2H3,(H,20,24)