4-azanyl-3-(azepan-1-ylmethyl)benzenecarbonitrile

Systemtic Name: 4-azanyl-3-(azepan-1-ylmethyl)benzenecarbonitrile Openeye Name: 4-amino-3-(azepan-1-ylmethyl)benzonitrile CAS Name: 4-amino-3-(1-azepanylmethyl)benzonitrile IUPAC Name: 4-amino-3-(azepan-1-ylmethyl)benzonitrile Traditional Name: 4-amino-3-(azepan-1-ylmethyl)benzonitrile Formula: C14H19N3 MolecularWeight: 229.32076

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CC2=C(C=CC(=C2)C#N)N

Isomeric SMILES

C1CCCN(CC1)CC2=C(C=CC(=C2)C#N)N

InChI

InChI=1S/C14H19N3/c15-10-12-5-6-14(16)13(9-12)11-17-7-3-1-2-4-8-17/h5-6,9H,1-4,7-8,11,16H2