(phenylmethyl) 2-azanyl-5-[5-cyano-2-[2-(3-pyridin-4-ylphenyl)carbonylprop-2-enoyloxy]phenoxy]pentanoate

Systemtic Name: (phenylmethyl) 2-azanyl-5-[5-cyano-2-[2-(3-pyridin-4-ylphenyl)carbonylprop-2-enoyloxy]phenoxy]pentanoate Openeye Name: benzyl 2-amino-5-[5-cyano-2-[2-[3-(4-pyridyl)benzoyl]prop-2-enoyloxy]phenoxy]pentanoate CAS Name: 2-amino-5-[5-cyano-2-[1-oxo-2-[oxo-(3-pyridin-4-ylphenyl)methyl]prop-2-enoxy]phenoxy]pentanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-amino-5-[5-cyano-2-[2-(3-pyridin-4-ylbenzoyl)prop-2-enoyloxy]phenoxy]pentanoate Traditional Name: 2-amino-5-[5-cyano-2-[2-[3-(4-pyridyl)benzoyl]acryloyl]oxy-phenoxy]valeric acid benzyl ester Formula: C34H29N3O6 MolecularWeight: 575.61056

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Descriptors Computed from Structure

Canonical SMILES:

C=C(C(=O)C1=CC=CC(=C1)C2=CC=NC=C2)C(=O)OC3=C(C=C(C=C3)C#N)OCCCC(C(=O)OCC4=CC=CC=C4)N

Isomeric SMILES

C=C(C(=O)C1=CC=CC(=C1)C2=CC=NC=C2)C(=O)OC3=C(C=C(C=C3)C#N)OCCCC(C(=O)OCC4=CC=CC=C4)N

InChI

InChI=1S/C34H29N3O6/c1-23(32(38)28-10-5-9-27(20-28)26-14-16-37-17-15-26)33(39)43-30-13-12-25(21-35)19-31(30)41-18-6-11-29(36)34(40)42-22-24-7-3-2-4-8-24/h2-5,7-10,12-17,19-20,29H,1,6,11,18,22,36H2