[2,6-bis(bromanyl)-4-[(4-butoxyphenyl)carbonylamino]phenyl] 4-butoxybenzoate

Systemtic Name: [2,6-bis(bromanyl)-4-[(4-butoxyphenyl)carbonylamino]phenyl] 4-butoxybenzoate Openeye Name: [2,6-dibromo-4-[(4-butoxybenzoyl)amino]phenyl] 4-butoxybenzoate CAS Name: 4-butoxybenzoic acid [2,6-dibromo-4-[[(4-butoxyphenyl)-oxomethyl]amino]phenyl] ester IUPAC Name: [2,6-dibromo-4-[(4-butoxybenzoyl)amino]phenyl] 4-butoxybenzoate Traditional Name: 4-butoxybenzoic acid [2,6-dibromo-4-[(4-butoxybenzoyl)amino]phenyl] ester Formula: C28H29Br2NO5 MolecularWeight: 619.34156

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC2=CC(=C(C(=C2)Br)OC(=O)C3=CC=C(C=C3)OCCCC)Br

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC2=CC(=C(C(=C2)Br)OC(=O)C3=CC=C(C=C3)OCCCC)Br

InChI

InChI=1S/C28H29Br2NO5/c1-3-5-15-34-22-11-7-19(8-12-22)27(32)31-21-17-24(29)26(25(30)18-21)36-28(33)20-9-13-23(14-10-20)35-16-6-4-2/h7-14,17-18H,3-6,15-16H2,1-2H3,(H,31,32)