[4-bromanyl-2-[(E)-[[4-(phenylsulfonylamino)phenyl]carbonylhydrazinylidene]methyl]phenyl] 4-propoxybenzoate

Systemtic Name: [4-bromanyl-2-[(E)-[[4-(phenylsulfonylamino)phenyl]carbonylhydrazinylidene]methyl]phenyl] 4-propoxybenzoate Openeye Name: [2-[(E)-[[4-(benzenesulfonamido)benzoyl]hydrazono]methyl]-4-bromo-phenyl] 4-propoxybenzoate CAS Name: 4-propoxybenzoic acid [2-[(E)-[[[4-(benzenesulfonamido)phenyl]-oxomethyl]hydrazinylidene]methyl]-4-bromophenyl] ester IUPAC Name: [2-[(E)-[[4-(benzenesulfonamido)benzoyl]hydrazinylidene]methyl]-4-bromophenyl] 4-propoxybenzoate Traditional Name: 4-propoxybenzoic acid [2-[(E)-[[4-(benzenesulfonamido)benzoyl]hydrazono]methyl]-4-bromo-phenyl] ester Formula: C30H26BrN3O6S MolecularWeight: 636.51294

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)Br)C=NNC(=O)C3=CC=C(C=C3)NS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)Br)/C=N/NC(=O)C3=CC=C(C=C3)NS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C30H26BrN3O6S/c1-2-18-39-26-15-10-22(11-16-26)30(36)40-28-17-12-24(31)19-23(28)20-32-33-29(35)21-8-13-25(14-9-21)34-41(37,38)27-6-4-3-5-7-27/h3-17,19-20,34H,2,18H2,1H3,(H,33,35)/b32-20+