[4-[(E)-[2-(naphthalen-1-ylcarbonylamino)ethanoylhydrazinylidene]methyl]phenyl] 4-bromanylbenzoate

Systemtic Name: [4-[(E)-[2-(naphthalen-1-ylcarbonylamino)ethanoylhydrazinylidene]methyl]phenyl] 4-bromanylbenzoate Openeye Name: [4-[(E)-[[2-(naphthalene-1-carbonylamino)acetyl]hydrazono]methyl]phenyl] 4-bromobenzoate CAS Name: 4-bromobenzoic acid [4-[(E)-[[2-[[1-naphthalenyl(oxo)methyl]amino]-1-oxoethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-[(E)-[[2-(naphthalene-1-carbonylamino)acetyl]hydrazinylidene]methyl]phenyl] 4-bromobenzoate Traditional Name: 4-bromobenzoic acid [4-[(E)-[[2-(1-naphthoylamino)acetyl]hydrazono]methyl]phenyl] ester Formula: C27H20BrN3O4 MolecularWeight: 530.3694

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2C(=O)NCC(=O)NN=CC3=CC=C(C=C3)OC(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2C(=O)NCC(=O)N/N=C/C3=CC=C(C=C3)OC(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C27H20BrN3O4/c28-21-12-10-20(11-13-21)27(34)35-22-14-8-18(9-15-22)16-30-31-25(32)17-29-26(33)24-7-3-5-19-4-1-2-6-23(19)24/h1-16H,17H2,(H,29,33)(H,31,32)/b30-16+