ethyl 2-[(2-azanyl-5-bromanyl-6-ethenyl-3-nitro-phenyl)methyl-methyl-amino]ethanoate

Systemtic Name: ethyl 2-[(2-azanyl-5-bromanyl-6-ethenyl-3-nitro-phenyl)methyl-methyl-amino]ethanoate Openeye Name: ethyl 2-[(2-amino-5-bromo-3-nitro-6-vinyl-phenyl)methyl-methyl-amino]acetate CAS Name: 2-[(2-amino-5-bromo-6-ethenyl-3-nitrophenyl)methyl-methylamino]acetic acid ethyl ester IUPAC Name: ethyl 2-[(2-amino-5-bromo-6-ethenyl-3-nitrophenyl)methyl-methylamino]acetate Traditional Name: 2-[(2-amino-5-bromo-3-nitro-6-vinyl-benzyl)-methyl-amino]acetic acid ethyl ester Formula: C14H18BrN3O4 MolecularWeight: 372.21442

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(C)CC1=C(C(=CC(=C1C=C)Br)[N+](=O)[O-])N

Isomeric SMILES

CCOC(=O)CN(C)CC1=C(C(=CC(=C1C=C)Br)[N+](=O)[O-])N

InChI

InChI=1S/C14H18BrN3O4/c1-4-9-10(7-17(3)8-13(19)22-5-2)14(16)12(18(20)21)6-11(9)15/h4,6H,1,5,7-8,16H2,2-3H3