4-[(3-phenylpropylamino)methyl]benzene-1,2-diol

Systemtic Name: 4-[(3-phenylpropylamino)methyl]benzene-1,2-diol Openeye Name: 4-[(3-phenylpropylamino)methyl]benzene-1,2-diol CAS Name: 4-[(3-phenylpropylamino)methyl]benzene-1,2-diol IUPAC Name: 4-[(3-phenylpropylamino)methyl]benzene-1,2-diol Traditional Name: 4-[(3-phenylpropylamino)methyl]pyrocatechol Formula: C16H19NO2 MolecularWeight: 257.32756

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCNCC2=CC(=C(C=C2)O)O

Isomeric SMILES

C1=CC=C(C=C1)CCCNCC2=CC(=C(C=C2)O)O

InChI

InChI=1S/C16H19NO2/c18-15-9-8-14(11-16(15)19)12-17-10-4-7-13-5-2-1-3-6-13/h1-3,5-6,8-9,11,17-19H,4,7,10,12H2