4-[(3-bromophenyl)amino]-8-methyl-6-nitro-quinoline-3-carbonitrile

Systemtic Name: 4-[(3-bromophenyl)amino]-8-methyl-6-nitro-quinoline-3-carbonitrile Openeye Name: 4-(3-bromoanilino)-8-methyl-6-nitro-quinoline-3-carbonitrile CAS Name: 4-(3-bromoanilino)-8-methyl-6-nitro-3-quinolinecarbonitrile IUPAC Name: 4-(3-bromoanilino)-8-methyl-6-nitroquinoline-3-carbonitrile Traditional Name: 4-(3-bromoanilino)-8-methyl-6-nitro-quinoline-3-carbonitrile Formula: C17H11BrN4O2 MolecularWeight: 383.19884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)[N+](=O)[O-])C(=C(C=N2)C#N)NC3=CC(=CC=C3)Br

Isomeric SMILES

CC1=C2C(=CC(=C1)[N+](=O)[O-])C(=C(C=N2)C#N)NC3=CC(=CC=C3)Br

InChI

InChI=1S/C17H11BrN4O2/c1-10-5-14(22(23)24)7-15-16(10)20-9-11(8-19)17(15)21-13-4-2-3-12(18)6-13/h2-7,9H,1H3,(H,20,21)