N-[1-(3-bromophenyl)ethyl]-5-methoxy-4-(2-methoxyethoxy)-2-nitro-benzamide

Systemtic Name: N-[1-(3-bromophenyl)ethyl]-5-methoxy-4-(2-methoxyethoxy)-2-nitro-benzamide Openeye Name: N-[1-(3-bromophenyl)ethyl]-5-methoxy-4-(2-methoxyethoxy)-2-nitro-benzamide CAS Name: N-[1-(3-bromophenyl)ethyl]-5-methoxy-4-(2-methoxyethoxy)-2-nitrobenzamide IUPAC Name: N-[1-(3-bromophenyl)ethyl]-5-methoxy-4-(2-methoxyethoxy)-2-nitrobenzamide Traditional Name: N-[1-(3-bromophenyl)ethyl]-5-methoxy-4-(2-methoxyethoxy)-2-nitro-benzamide Formula: C19H21BrN2O6 MolecularWeight: 453.28384

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21BrN2O6/c1-12(13-5-4-6-14(20)9-13)21-19(23)15-10-17(27-3)18(28-8-7-26-2)11-16(15)22(24)25/h4-6,9-12H,7-8H2,1-3H3,(H,21,23)