ethyl 3-[3,5-bis[(3-bromanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-4-oxidanyl-phenyl]propanoate

Systemtic Name: ethyl 3-[3,5-bis[(3-bromanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-4-oxidanyl-phenyl]propanoate Openeye Name: ethyl 3-[3,5-bis[(3-bromo-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]-4-hydroxy-phenyl]propanoate CAS Name: 3-[3,5-bis[(3-bromo-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-4-hydroxyphenyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[3,5-bis[(3-bromo-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]-4-hydroxyphenyl]propanoate Traditional Name: 3-[3,5-bis[(3-bromo-6-keto-cyclohexa-2,4-dien-1-ylidene)methylamino]-4-hydroxy-phenyl]propionic acid ethyl ester Formula: C25H22Br2N2O5 MolecularWeight: 590.26058

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1=CC(=C(C(=C1)NC=C2C=C(C=CC2=O)Br)O)NC=C3C=C(C=CC3=O)Br

Isomeric SMILES

CCOC(=O)CCC1=CC(=C(C(=C1)NC=C2C=C(C=CC2=O)Br)O)NC=C3C=C(C=CC3=O)Br

InChI

InChI=1S/C25H22Br2N2O5/c1-2-34-24(32)8-3-15-9-20(28-13-16-11-18(26)4-6-22(16)30)25(33)21(10-15)29-14-17-12-19(27)5-7-23(17)31/h4-7,9-14,28-29,33H,2-3,8H2,1H3