2-[(E)-[5-[(4-bromophenyl)methoxy]-1-prop-2-enyl-indol-3-yl]methylideneamino]oxyethanoic acid

Systemtic Name: 2-[(E)-[5-[(4-bromophenyl)methoxy]-1-prop-2-enyl-indol-3-yl]methylideneamino]oxyethanoic acid Openeye Name: 2-[(E)-[1-allyl-5-[(4-bromophenyl)methoxy]indol-3-yl]methyleneamino]oxyacetic acid CAS Name: 2-[(E)-[5-[(4-bromophenyl)methoxy]-1-prop-2-enyl-3-indolyl]methylideneamino]oxyacetic acid IUPAC Name: 2-[(E)-[5-[(4-bromophenyl)methoxy]-1-prop-2-enylindol-3-yl]methylideneamino]oxyacetic acid Traditional Name: 2-[(E)-[1-allyl-5-(4-bromobenzyl)oxy-indol-3-yl]methyleneamino]oxyacetic acid Formula: C21H19BrN2O4 MolecularWeight: 443.29056

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C=C(C2=C1C=CC(=C2)OCC3=CC=C(C=C3)Br)C=NOCC(=O)O

Isomeric SMILES

C=CCN1C=C(C2=C1C=CC(=C2)OCC3=CC=C(C=C3)Br)/C=N/OCC(=O)O

InChI

InChI=1S/C21H19BrN2O4/c1-2-9-24-12-16(11-23-28-14-21(25)26)19-10-18(7-8-20(19)24)27-13-15-3-5-17(22)6-4-15/h2-8,10-12H,1,9,13-14H2,(H,25,26)/b23-11+