3-azanyl-1-(4-methoxyphenyl)-5,6,7,8-tetrahydro-1H-isochromene-4-carbonitrile

Systemtic Name: 3-azanyl-1-(4-methoxyphenyl)-5,6,7,8-tetrahydro-1H-isochromene-4-carbonitrile Openeye Name: 3-amino-1-(4-methoxyphenyl)-5,6,7,8-tetrahydro-1H-isochromene-4-carbonitrile CAS Name: 3-amino-1-(4-methoxyphenyl)-5,6,7,8-tetrahydro-1H-2-benzopyran-4-carbonitrile IUPAC Name: 3-amino-1-(4-methoxyphenyl)-5,6,7,8-tetrahydro-1H-isochromene-4-carbonitrile Traditional Name: 3-amino-1-(4-methoxyphenyl)-5,6,7,8-tetrahydro-1H-isochromene-4-carbonitrile Formula: C17H18N2O2 MolecularWeight: 282.33702

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2C3=C(CCCC3)C(=C(O2)N)C#N

Isomeric SMILES

COC1=CC=C(C=C1)C2C3=C(CCCC3)C(=C(O2)N)C#N

InChI

InChI=1S/C17H18N2O2/c1-20-12-8-6-11(7-9-12)16-14-5-3-2-4-13(14)15(10-18)17(19)21-16/h6-9,16H,2-5,19H2,1H3