phenyl 2-chloranyl-3-methyl-4-[2-[(E)-3-methylhept-5-enoxy]pyrimidin-5-yl]pentanoate

Systemtic Name: phenyl 2-chloranyl-3-methyl-4-[2-[(E)-3-methylhept-5-enoxy]pyrimidin-5-yl]pentanoate Openeye Name: phenyl 2-chloro-3-methyl-4-[2-[(E)-3-methylhept-5-enoxy]pyrimidin-5-yl]pentanoate CAS Name: 2-chloro-3-methyl-4-[2-[(E)-3-methylhept-5-enoxy]-5-pyrimidinyl]pentanoic acid phenyl ester IUPAC Name: phenyl 2-chloro-3-methyl-4-[2-[(E)-3-methylhept-5-enoxy]pyrimidin-5-yl]pentanoate Traditional Name: 2-chloro-3-methyl-4-[2-[(E)-3-methylhept-5-enoxy]pyrimidin-5-yl]valeric acid phenyl ester Formula: C24H31ClN2O3 MolecularWeight: 430.96754

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Descriptors Computed from Structure

Canonical SMILES:

CC=CCC(C)CCOC1=NC=C(C=N1)C(C)C(C)C(C(=O)OC2=CC=CC=C2)Cl

Isomeric SMILES

C/C=C/CC(C)CCOC1=NC=C(C=N1)C(C)C(C)C(C(=O)OC2=CC=CC=C2)Cl

InChI

InChI=1S/C24H31ClN2O3/c1-5-6-10-17(2)13-14-29-24-26-15-20(16-27-24)18(3)19(4)22(25)23(28)30-21-11-8-7-9-12-21/h5-9,11-12,15-19,22H,10,13-14H2,1-4H3/b6-5+