2-(azepan-1-ylmethyl)-3-bromanyl-aniline

Systemtic Name: 2-(azepan-1-ylmethyl)-3-bromanyl-aniline Openeye Name: 2-(azepan-1-ylmethyl)-3-bromo-aniline CAS Name: 2-(1-azepanylmethyl)-3-bromoaniline IUPAC Name: 2-(azepan-1-ylmethyl)-3-bromoaniline Traditional Name: [2-(azepan-1-ylmethyl)-3-bromo-phenyl]amine Formula: C13H19BrN2 MolecularWeight: 283.20736

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CC2=C(C=CC=C2Br)N

Isomeric SMILES

C1CCCN(CC1)CC2=C(C=CC=C2Br)N

InChI

InChI=1S/C13H19BrN2/c14-12-6-5-7-13(15)11(12)10-16-8-3-1-2-4-9-16/h5-7H,1-4,8-10,15H2