N-[2-[(2-bromanyl-4,6-dinitro-phenyl)diazenyl]-4-methoxy-5-[(3-methoxy-2-oxidanyl-propyl)-prop-2-enyl-amino]phenyl]ethanamide

Systemtic Name: N-[2-[(2-bromanyl-4,6-dinitro-phenyl)diazenyl]-4-methoxy-5-[(3-methoxy-2-oxidanyl-propyl)-prop-2-enyl-amino]phenyl]ethanamide Openeye Name: N-[5-[allyl-(2-hydroxy-3-methoxy-propyl)amino]-2-(2-bromo-4,6-dinitro-phenyl)azo-4-methoxy-phenyl]acetamide CAS Name: N-[2-(2-bromo-4,6-dinitrophenyl)azo-5-[(2-hydroxy-3-methoxypropyl)-prop-2-enylamino]-4-methoxyphenyl]acetamide IUPAC Name: N-[2-[(2-bromo-4,6-dinitrophenyl)diazenyl]-5-[(2-hydroxy-3-methoxypropyl)-prop-2-enylamino]-4-methoxyphenyl]acetamide Traditional Name: N-[5-[allyl-(2-hydroxy-3-methoxy-propyl)amino]-2-(2-bromo-4,6-dinitro-phenyl)azo-4-methoxy-phenyl]acetamide Formula: C22H25BrN6O8 MolecularWeight: 581.3733

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1N=NC2=C(C=C(C=C2Br)[N+](=O)[O-])[N+](=O)[O-])OC)N(CC=C)CC(COC)O

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1N=NC2=C(C=C(C=C2Br)[N+](=O)[O-])[N+](=O)[O-])OC)N(CC=C)CC(COC)O

InChI

InChI=1S/C22H25BrN6O8/c1-5-6-27(11-15(31)12-36-3)19-9-17(24-13(2)30)18(10-21(19)37-4)25-26-22-16(23)7-14(28(32)33)8-20(22)29(34)35/h5,7-10,15,31H,1,6,11-12H2,2-4H3,(H,24,30)