2-(3,4,5,6-tetrahydro-2H-azepin-7-ylamino)benzenecarbonitrile

Systemtic Name: 2-(3,4,5,6-tetrahydro-2H-azepin-7-ylamino)benzenecarbonitrile Openeye Name: 2-(3,4,5,6-tetrahydro-2H-azepin-7-ylamino)benzonitrile CAS Name: 2-(3,4,5,6-tetrahydro-2H-azepin-7-ylamino)benzonitrile IUPAC Name: 2-(3,4,5,6-tetrahydro-2H-azepin-7-ylamino)benzonitrile Traditional Name: 2-(3,4,5,6-tetrahydro-2H-azepin-7-ylamino)benzonitrile Formula: C13H15N3 MolecularWeight: 213.2783

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=NCC1)NC2=CC=CC=C2C#N

Isomeric SMILES

C1CCC(=NCC1)NC2=CC=CC=C2C#N

InChI

InChI=1S/C13H15N3/c14-10-11-6-3-4-7-12(11)16-13-8-2-1-5-9-15-13/h3-4,6-7H,1-2,5,8-9H2,(H,15,16)