[2-tert-butyl-4-[[3-(isoquinolin-4-ylmethoxy)phenyl]carbamoyl]phenyl] ethanoate

Systemtic Name: [2-tert-butyl-4-[[3-(isoquinolin-4-ylmethoxy)phenyl]carbamoyl]phenyl] ethanoate Openeye Name: [2-tert-butyl-4-[[3-(4-isoquinolylmethoxy)phenyl]carbamoyl]phenyl] acetate CAS Name: acetic acid [2-tert-butyl-4-[[3-(4-isoquinolinylmethoxy)anilino]-oxomethyl]phenyl] ester IUPAC Name: [2-tert-butyl-4-[[3-(isoquinolin-4-ylmethoxy)phenyl]carbamoyl]phenyl] acetate Traditional Name: acetic acid [2-tert-butyl-4-[[3-(4-isoquinolylmethoxy)phenyl]carbamoyl]phenyl] ester Formula: C29H28N2O4 MolecularWeight: 468.54362

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1)C(=O)NC2=CC(=CC=C2)OCC3=CN=CC4=CC=CC=C43)C(C)(C)C

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1)C(=O)NC2=CC(=CC=C2)OCC3=CN=CC4=CC=CC=C43)C(C)(C)C

InChI

InChI=1S/C29H28N2O4/c1-19(32)35-27-13-12-20(14-26(27)29(2,3)4)28(33)31-23-9-7-10-24(15-23)34-18-22-17-30-16-21-8-5-6-11-25(21)22/h5-17H,18H2,1-4H3,(H,31,33)