5-bromanyl-3-[(3,4,5-trimethoxyphenyl)carbonylamino]-1H-indole-2-carboxylate

Systemtic Name: 5-bromanyl-3-[(3,4,5-trimethoxyphenyl)carbonylamino]-1H-indole-2-carboxylate Openeye Name: 5-bromo-3-[(3,4,5-trimethoxybenzoyl)amino]-1H-indole-2-carboxylate CAS Name: 5-bromo-3-[[oxo-(3,4,5-trimethoxyphenyl)methyl]amino]-1H-indole-2-carboxylate IUPAC Name: 5-bromo-3-[(3,4,5-trimethoxybenzoyl)amino]-1H-indole-2-carboxylate Traditional Name: 5-bromo-3-[(3,4,5-trimethoxybenzoyl)amino]-1H-indole-2-carboxylate Formula: C19H16BrN2O6- MolecularWeight: 448.24414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)NC2=C(NC3=C2C=C(C=C3)Br)C(=O)[O-]

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)NC2=C(NC3=C2C=C(C=C3)Br)C(=O)[O-]

InChI

InChI=1S/C19H17BrN2O6/c1-26-13-6-9(7-14(27-2)17(13)28-3)18(23)22-15-11-8-10(20)4-5-12(11)21-16(15)19(24)25/h4-8,21H,1-3H3,(H,22,23)(H,24,25)/p-1