N-[1-(4-bromophenyl)ethyl]-4-(2-methoxyethylamino)-3-nitro-benzamide

Systemtic Name: N-[1-(4-bromophenyl)ethyl]-4-(2-methoxyethylamino)-3-nitro-benzamide Openeye Name: N-[1-(4-bromophenyl)ethyl]-4-(2-methoxyethylamino)-3-nitro-benzamide CAS Name: N-[1-(4-bromophenyl)ethyl]-4-(2-methoxyethylamino)-3-nitrobenzamide IUPAC Name: N-[1-(4-bromophenyl)ethyl]-4-(2-methoxyethylamino)-3-nitrobenzamide Traditional Name: N-[1-(4-bromophenyl)ethyl]-4-(2-methoxyethylamino)-3-nitro-benzamide Formula: C18H20BrN3O4 MolecularWeight: 422.2731

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20BrN3O4/c1-12(13-3-6-15(19)7-4-13)21-18(23)14-5-8-16(20-9-10-26-2)17(11-14)22(24)25/h3-8,11-12,20H,9-10H2,1-2H3,(H,21,23)