4-bromanyl-N-[2-[[3-(cyclopropylamino)-4-nitro-phenyl]amino]ethyl]benzamide

Systemtic Name: 4-bromanyl-N-[2-[[3-(cyclopropylamino)-4-nitro-phenyl]amino]ethyl]benzamide Openeye Name: 4-bromo-N-[2-[3-(cyclopropylamino)-4-nitro-anilino]ethyl]benzamide CAS Name: 4-bromo-N-[2-[3-(cyclopropylamino)-4-nitroanilino]ethyl]benzamide IUPAC Name: 4-bromo-N-[2-[3-(cyclopropylamino)-4-nitroanilino]ethyl]benzamide Traditional Name: 4-bromo-N-[2-[3-(cyclopropylamino)-4-nitro-anilino]ethyl]benzamide Formula: C18H19BrN4O3 MolecularWeight: 419.27246

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC2=C(C=CC(=C2)NCCNC(=O)C3=CC=C(C=C3)Br)[N+](=O)[O-]

Isomeric SMILES

C1CC1NC2=C(C=CC(=C2)NCCNC(=O)C3=CC=C(C=C3)Br)[N+](=O)[O-]

InChI

InChI=1S/C18H19BrN4O3/c19-13-3-1-12(2-4-13)18(24)21-10-9-20-15-7-8-17(23(25)26)16(11-15)22-14-5-6-14/h1-4,7-8,11,14,20,22H,5-6,9-10H2,(H,21,24)