[4-[(4-cyanophenyl)amino]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-5-yl] 2-methoxyethanoate

Systemtic Name: [4-[(4-cyanophenyl)amino]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-5-yl] 2-methoxyethanoate Openeye Name: [4-(4-cyanoanilino)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-5-yl] 2-methoxyacetate CAS Name: 2-methoxyacetic acid [4-(4-cyanoanilino)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-5-yl] ester IUPAC Name: [4-(4-cyanoanilino)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-5-yl] 2-methoxyacetate Traditional Name: 2-methoxyacetic acid [4-(4-cyanoanilino)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-5-yl] ester Formula: C17H16N4O3 MolecularWeight: 324.33394

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Descriptors Computed from Structure

Canonical SMILES:

COCC(=O)OC1CCC2=C1C(=NC=N2)NC3=CC=C(C=C3)C#N

Isomeric SMILES

COCC(=O)OC1CCC2=C1C(=NC=N2)NC3=CC=C(C=C3)C#N

InChI

InChI=1S/C17H16N4O3/c1-23-9-15(22)24-14-7-6-13-16(14)17(20-10-19-13)21-12-4-2-11(8-18)3-5-12/h2-5,10,14H,6-7,9H2,1H3,(H,19,20,21)