[4-(azepan-1-ylsulfonylmethyl)phenyl]methanamine

Systemtic Name: [4-(azepan-1-ylsulfonylmethyl)phenyl]methanamine Openeye Name: [4-(azepan-1-ylsulfonylmethyl)phenyl]methanamine CAS Name: [4-(1-azepanylsulfonylmethyl)phenyl]methanamine IUPAC Name: [4-(azepan-1-ylsulfonylmethyl)phenyl]methanamine Traditional Name: [4-(azepan-1-ylsulfonylmethyl)benzyl]amine Formula: C14H22N2O2S MolecularWeight: 282.40168

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)CC2=CC=C(C=C2)CN

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)CC2=CC=C(C=C2)CN

InChI

InChI=1S/C14H22N2O2S/c15-11-13-5-7-14(8-6-13)12-19(17,18)16-9-3-1-2-4-10-16/h5-8H,1-4,9-12,15H2