benzene-1,3-diamine; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol; isoindole-1,3-dione

Systemtic Name: benzene-1,3-diamine; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol; isoindole-1,3-dione Openeye Name: benzene-1,3-diamine; 4-[1-(4-hydroxyphenyl)-1-methyl-ethyl]phenol; isoindoline-1,3-dione CAS Name: benzene-1,3-diamine; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol; isoindole-1,3-dione IUPAC Name: benzene-1,3-diamine; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol; isoindole-1,3-dione Traditional Name: 4-[1-(4-hydroxyphenyl)-1-methyl-ethyl]phenol; m-phenylenediamine; phthalimide Formula: C29H29N3O4 MolecularWeight: 483.55826

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C1=CC=C2C(=C1)C(=O)NC2=O.C1=CC(=CC(=C1)N)N

Isomeric SMILES

CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C1=CC=C2C(=C1)C(=O)NC2=O.C1=CC(=CC(=C1)N)N

InChI

InChI=1S/C15H16O2.C8H5NO2.C6H8N2/c1-15(2,11-3-7-13(16)8-4-11)12-5-9-14(17)10-6-12;10-7-5-3-1-2-4-6(5)8(11)9-7;7-5-2-1-3-6(8)4-5/h3-10,16-17H,1-2H3;1-4H,(H,9,10,11);1-4H,7-8H2