N-[(5-bromanyl-2-methoxy-phenyl)methyl]-4-(ethylamino)-N-methyl-3-nitro-benzamide

Systemtic Name: N-[(5-bromanyl-2-methoxy-phenyl)methyl]-4-(ethylamino)-N-methyl-3-nitro-benzamide Openeye Name: N-[(5-bromo-2-methoxy-phenyl)methyl]-4-(ethylamino)-N-methyl-3-nitro-benzamide CAS Name: N-[(5-bromo-2-methoxyphenyl)methyl]-4-(ethylamino)-N-methyl-3-nitrobenzamide IUPAC Name: N-[(5-bromo-2-methoxyphenyl)methyl]-4-(ethylamino)-N-methyl-3-nitrobenzamide Traditional Name: N-(5-bromo-2-methoxy-benzyl)-4-(ethylamino)-N-methyl-3-nitro-benzamide Formula: C18H20BrN3O4 MolecularWeight: 422.2731

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C=C(C=C1)C(=O)N(C)CC2=C(C=CC(=C2)Br)OC)[N+](=O)[O-]

Isomeric SMILES

CCNC1=C(C=C(C=C1)C(=O)N(C)CC2=C(C=CC(=C2)Br)OC)[N+](=O)[O-]

InChI

InChI=1S/C18H20BrN3O4/c1-4-20-15-7-5-12(10-16(15)22(24)25)18(23)21(2)11-13-9-14(19)6-8-17(13)26-3/h5-10,20H,4,11H2,1-3H3