4-[2-azanyl-1-(azepan-1-yl)ethyl]benzene-1,2-diol

Systemtic Name: 4-[2-azanyl-1-(azepan-1-yl)ethyl]benzene-1,2-diol Openeye Name: 4-[2-amino-1-(azepan-1-yl)ethyl]benzene-1,2-diol CAS Name: 4-[2-amino-1-(1-azepanyl)ethyl]benzene-1,2-diol IUPAC Name: 4-[2-amino-1-(azepan-1-yl)ethyl]benzene-1,2-diol Traditional Name: 4-[2-amino-1-(azepan-1-yl)ethyl]pyrocatechol Formula: C14H22N2O2 MolecularWeight: 250.33668

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H22N2O2/c15-10-12(16-7-3-1-2-4-8-16)11-5-6-13(17)14(18)9-11/h5-6,9,12,17-18H,1-4,7-8,10,15H2