3-chloranyl-4-[2-(propan-2-ylamino)butyl]benzene-1,2-diol

Systemtic Name: 3-chloranyl-4-[2-(propan-2-ylamino)butyl]benzene-1,2-diol Openeye Name: 3-chloro-4-[2-(isopropylamino)butyl]benzene-1,2-diol CAS Name: 3-chloro-4-[2-(propan-2-ylamino)butyl]benzene-1,2-diol IUPAC Name: 3-chloro-4-[2-(propan-2-ylamino)butyl]benzene-1,2-diol Traditional Name: 3-chloro-4-[2-(isopropylamino)butyl]pyrocatechol Formula: C13H20ClNO2 MolecularWeight: 257.7564

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=C(C(=C(C=C1)O)O)Cl)NC(C)C

Isomeric SMILES

CCC(CC1=C(C(=C(C=C1)O)O)Cl)NC(C)C

InChI

InChI=1S/C13H20ClNO2/c1-4-10(15-8(2)3)7-9-5-6-11(16)13(17)12(9)14/h5-6,8,10,15-17H,4,7H2,1-3H3