6-(3-cyclopentyloxy-4-methoxy-phenyl)-4-oxidanylidene-1,5,7,8-tetrahydroquinazoline-6-carbonitrile

Systemtic Name: 6-(3-cyclopentyloxy-4-methoxy-phenyl)-4-oxidanylidene-1,5,7,8-tetrahydroquinazoline-6-carbonitrile Openeye Name: 6-[3-(cyclopentoxy)-4-methoxy-phenyl]-4-oxo-1,5,7,8-tetrahydroquinazoline-6-carbonitrile CAS Name: 6-(3-cyclopentyloxy-4-methoxyphenyl)-4-oxo-1,5,7,8-tetrahydroquinazoline-6-carbonitrile IUPAC Name: 6-(3-cyclopentyloxy-4-methoxyphenyl)-4-oxo-1,5,7,8-tetrahydroquinazoline-6-carbonitrile Traditional Name: 6-[3-(cyclopentoxy)-4-methoxy-phenyl]-4-keto-1,5,7,8-tetrahydroquinazoline-6-carbonitrile Formula: C21H23N3O3 MolecularWeight: 365.42562

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2(CCC3=C(C2)C(=O)N=CN3)C#N)OC4CCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)C2(CCC3=C(C2)C(=O)N=CN3)C#N)OC4CCCC4

InChI

InChI=1S/C21H23N3O3/c1-26-18-7-6-14(10-19(18)27-15-4-2-3-5-15)21(12-22)9-8-17-16(11-21)20(25)24-13-23-17/h6-7,10,13,15H,2-5,8-9,11H2,1H3,(H,23,24,25)