4-[3-(2-hydroxyethyl)-2-oxidanylidene-5,6,7,7a-tetrahydro-4H-indol-1-yl]-3-methoxy-benzenecarbonitrile

Systemtic Name: 4-[3-(2-hydroxyethyl)-2-oxidanylidene-5,6,7,7a-tetrahydro-4H-indol-1-yl]-3-methoxy-benzenecarbonitrile Openeye Name: 4-[3-(2-hydroxyethyl)-2-oxo-5,6,7,7a-tetrahydro-4H-indol-1-yl]-3-methoxy-benzonitrile CAS Name: 4-[3-(2-hydroxyethyl)-2-oxo-5,6,7,7a-tetrahydro-4H-indol-1-yl]-3-methoxybenzonitrile IUPAC Name: 4-[3-(2-hydroxyethyl)-2-oxo-5,6,7,7a-tetrahydro-4H-indol-1-yl]-3-methoxybenzonitrile Traditional Name: 4-[3-(2-hydroxyethyl)-2-keto-5,6,7,7a-tetrahydro-4H-indol-1-yl]-3-methoxy-benzonitrile Formula: C18H20N2O3 MolecularWeight: 312.363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C#N)N2C3CCCCC3=C(C2=O)CCO

Isomeric SMILES

COC1=C(C=CC(=C1)C#N)N2C3CCCCC3=C(C2=O)CCO

InChI

InChI=1S/C18H20N2O3/c1-23-17-10-12(11-19)6-7-16(17)20-15-5-3-2-4-13(15)14(8-9-21)18(20)22/h6-7,10,15,21H,2-5,8-9H2,1H3