2-[[3,4-bis(bromanyl)phenyl]amino]-1,4,4a,8a-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 2-[[3,4-bis(bromanyl)phenyl]amino]-1,4,4a,8a-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-(3,4-dibromoanilino)-1,4,4a,8a-tetrahydroquinoline-3-carbonitrile CAS Name: 2-(3,4-dibromoanilino)-1,4,4a,8a-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-(3,4-dibromoanilino)-1,4,4a,8a-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-(3,4-dibromoanilino)-1,4,4a,8a-tetrahydroquinoline-3-carbonitrile Formula: C16H13Br2N3 MolecularWeight: 407.10252

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Descriptors Computed from Structure

Canonical SMILES:

C1C2C=CC=CC2NC(=C1C#N)NC3=CC(=C(C=C3)Br)Br

Isomeric SMILES

C1C2C=CC=CC2NC(=C1C#N)NC3=CC(=C(C=C3)Br)Br

InChI

InChI=1S/C16H13Br2N3/c17-13-6-5-12(8-14(13)18)20-16-11(9-19)7-10-3-1-2-4-15(10)21-16/h1-6,8,10,15,20-21H,7H2