N-(4-bromanyl-2-methyl-phenyl)-3-(6-nitroindazol-1-yl)propanamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-3-(6-nitroindazol-1-yl)propanamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-3-(6-nitroindazol-1-yl)propanamide CAS Name: N-(4-bromo-2-methylphenyl)-3-(6-nitro-1-indazolyl)propanamide IUPAC Name: N-(4-bromo-2-methylphenyl)-3-(6-nitroindazol-1-yl)propanamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-3-(6-nitroindazol-1-yl)propionamide Formula: C17H15BrN4O3 MolecularWeight: 403.23

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CCN2C3=C(C=CC(=C3)[N+](=O)[O-])C=N2

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CCN2C3=C(C=CC(=C3)[N+](=O)[O-])C=N2

InChI

InChI=1S/C17H15BrN4O3/c1-11-8-13(18)3-5-15(11)20-17(23)6-7-21-16-9-14(22(24)25)4-2-12(16)10-19-21/h2-5,8-10H,6-7H2,1H3,(H,20,23)