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

Systemtic Name: 4-[(3-bromophenyl)amino]-8-(dimethylaminomethyl)-6-nitro-quinoline-3-carbonitrile Openeye Name: 4-(3-bromoanilino)-8-(dimethylaminomethyl)-6-nitro-quinoline-3-carbonitrile CAS Name: 4-(3-bromoanilino)-8-(dimethylaminomethyl)-6-nitro-3-quinolinecarbonitrile IUPAC Name: 4-(3-bromoanilino)-8-(dimethylaminomethyl)-6-nitroquinoline-3-carbonitrile Traditional Name: 4-(3-bromoanilino)-8-(dimethylaminomethyl)-6-nitro-quinoline-3-carbonitrile Formula: C19H16BrN5O2 MolecularWeight: 426.26664

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H16BrN5O2/c1-24(2)11-12-6-16(25(26)27)8-17-18(12)22-10-13(9-21)19(17)23-15-5-3-4-14(20)7-15/h3-8,10H,11H2,1-2H3,(H,22,23)