2-[4-chloranyl-3-(1-diethylphosphanylpropoxy)phenyl]-3a,4,5,7a-tetrahydroisoindole-1,3-dione

Systemtic Name: 2-[4-chloranyl-3-(1-diethylphosphanylpropoxy)phenyl]-3a,4,5,7a-tetrahydroisoindole-1,3-dione Openeye Name: 2-[4-chloro-3-(1-diethylphosphanylpropoxy)phenyl]-3a,4,5,7a-tetrahydroisoindole-1,3-dione CAS Name: 2-[4-chloro-3-(1-diethylphosphinopropoxy)phenyl]-3a,4,5,7a-tetrahydroisoindole-1,3-dione IUPAC Name: 2-[4-chloro-3-(1-diethylphosphanylpropoxy)phenyl]-3a,4,5,7a-tetrahydroisoindole-1,3-dione Traditional Name: 2-[4-chloro-3-(1-diethylphosphinopropoxy)phenyl]-3a,4,5,7a-tetrahydroisoindole-1,3-quinone Formula: C21H27ClNO3P MolecularWeight: 407.870741

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Descriptors Computed from Structure

Canonical SMILES:

CCC(OC1=C(C=CC(=C1)N2C(=O)C3CCC=CC3C2=O)Cl)P(CC)CC

Isomeric SMILES

CCC(OC1=C(C=CC(=C1)N2C(=O)C3CCC=CC3C2=O)Cl)P(CC)CC

InChI

InChI=1S/C21H27ClNO3P/c1-4-19(27(5-2)6-3)26-18-13-14(11-12-17(18)22)23-20(24)15-9-7-8-10-16(15)21(23)25/h7,9,11-13,15-16,19H,4-6,8,10H2,1-3H3