tert-butyl 2-[4-(2-phenoxyethanoyl)piperazin-1-yl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxylate

Systemtic Name: tert-butyl 2-[4-(2-phenoxyethanoyl)piperazin-1-yl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxylate Openeye Name: tert-butyl 2-[4-(2-phenoxyacetyl)piperazin-1-yl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxylate CAS Name: 2-[4-(1-oxo-2-phenoxyethyl)-1-piperazinyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[4-(2-phenoxyacetyl)piperazin-1-yl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxylate Traditional Name: 2-[4-(2-phenoxyacetyl)piperazino]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxylic acid tert-butyl ester Formula: C24H31N5O4 MolecularWeight: 453.53404

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC2=NC(=NC=C2C1)N3CCN(CC3)C(=O)COC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC2=NC(=NC=C2C1)N3CCN(CC3)C(=O)COC4=CC=CC=C4

InChI

InChI=1S/C24H31N5O4/c1-24(2,3)33-23(31)29-10-9-20-18(16-29)15-25-22(26-20)28-13-11-27(12-14-28)21(30)17-32-19-7-5-4-6-8-19/h4-8,15H,9-14,16-17H2,1-3H3