[3-bromanyl-4-[[4-(4-prop-2-enoxybutoxy)phenoxy]methylamino]phenyl] 4-prop-2-enoylbenzoate

Systemtic Name: [3-bromanyl-4-[[4-(4-prop-2-enoxybutoxy)phenoxy]methylamino]phenyl] 4-prop-2-enoylbenzoate Openeye Name: [4-[[4-(4-allyloxybutoxy)phenoxy]methylamino]-3-bromo-phenyl] 4-prop-2-enoylbenzoate CAS Name: 4-(1-oxoprop-2-enyl)benzoic acid [3-bromo-4-[[4-(4-prop-2-enoxybutoxy)phenoxy]methylamino]phenyl] ester IUPAC Name: [3-bromo-4-[[4-(4-prop-2-enoxybutoxy)phenoxy]methylamino]phenyl] 4-prop-2-enoylbenzoate Traditional Name: 4-acryloylbenzoic acid [4-[[4-(4-allyloxybutoxy)phenoxy]methylamino]-3-bromo-phenyl] ester Formula: C30H30BrNO6 MolecularWeight: 580.4663

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOCCCCOC1=CC=C(C=C1)OCNC2=C(C=C(C=C2)OC(=O)C3=CC=C(C=C3)C(=O)C=C)Br

Isomeric SMILES

C=CCOCCCCOC1=CC=C(C=C1)OCNC2=C(C=C(C=C2)OC(=O)C3=CC=C(C=C3)C(=O)C=C)Br

InChI

InChI=1S/C30H30BrNO6/c1-3-17-35-18-5-6-19-36-24-11-13-25(14-12-24)37-21-32-28-16-15-26(20-27(28)31)38-30(34)23-9-7-22(8-10-23)29(33)4-2/h3-4,7-16,20,32H,1-2,5-6,17-19,21H2