N-[5-(4-bromophenyl)-1H-1,2,4-triazol-3-yl]-2,2-dimethyl-3-(9-nitro-10H-anthracen-9-yl)propanamide

Systemtic Name: N-[5-(4-bromophenyl)-1H-1,2,4-triazol-3-yl]-2,2-dimethyl-3-(9-nitro-10H-anthracen-9-yl)propanamide Openeye Name: N-[5-(4-bromophenyl)-1H-1,2,4-triazol-3-yl]-2,2-dimethyl-3-(9-nitro-10H-anthracen-9-yl)propanamide CAS Name: N-[5-(4-bromophenyl)-1H-1,2,4-triazol-3-yl]-2,2-dimethyl-3-(9-nitro-10H-anthracen-9-yl)propanamide IUPAC Name: N-[5-(4-bromophenyl)-1H-1,2,4-triazol-3-yl]-2,2-dimethyl-3-(9-nitro-10H-anthracen-9-yl)propanamide Traditional Name: N-[5-(4-bromophenyl)-1H-1,2,4-triazol-3-yl]-2,2-dimethyl-3-(9-nitro-10H-anthracen-9-yl)propionamide Formula: C27H24BrN5O3 MolecularWeight: 546.41516

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC1(C2=CC=CC=C2CC3=CC=CC=C31)[N+](=O)[O-])C(=O)NC4=NNC(=N4)C5=CC=C(C=C5)Br

Isomeric SMILES

CC(C)(CC1(C2=CC=CC=C2CC3=CC=CC=C31)[N+](=O)[O-])C(=O)NC4=NNC(=N4)C5=CC=C(C=C5)Br

InChI

InChI=1S/C27H24BrN5O3/c1-26(2,24(34)30-25-29-23(31-32-25)17-11-13-20(28)14-12-17)16-27(33(35)36)21-9-5-3-7-18(21)15-19-8-4-6-10-22(19)27/h3-14H,15-16H2,1-2H3,(H2,29,30,31,32,34)