2-[4-chloranyl-3-(prop-1-ynylamino)phenyl]-4,5,6,7-tetrahydroisoindole-1,3-dione

Systemtic Name: 2-[4-chloranyl-3-(prop-1-ynylamino)phenyl]-4,5,6,7-tetrahydroisoindole-1,3-dione Openeye Name: 2-[4-chloro-3-(prop-1-ynylamino)phenyl]-4,5,6,7-tetrahydroisoindole-1,3-dione CAS Name: 2-[4-chloro-3-(prop-1-ynylamino)phenyl]-4,5,6,7-tetrahydroisoindole-1,3-dione IUPAC Name: 2-[4-chloro-3-(prop-1-ynylamino)phenyl]-4,5,6,7-tetrahydroisoindole-1,3-dione Traditional Name: 2-[4-chloro-3-(prop-1-ynylamino)phenyl]-4,5,6,7-tetrahydroisoindole-1,3-quinone Formula: C17H15ClN2O2 MolecularWeight: 314.7662

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Descriptors Computed from Structure

Canonical SMILES:

CC#CNC1=C(C=CC(=C1)N2C(=O)C3=C(C2=O)CCCC3)Cl

Isomeric SMILES

CC#CNC1=C(C=CC(=C1)N2C(=O)C3=C(C2=O)CCCC3)Cl

InChI

InChI=1S/C17H15ClN2O2/c1-2-9-19-15-10-11(7-8-14(15)18)20-16(21)12-5-3-4-6-13(12)17(20)22/h7-8,10,19H,3-6H2,1H3