ethyl (4Z)-6-bromanyl-2-methyl-5-oxidanylidene-4-(phenylhydrazinylidene)-1-(phenylmethyl)indole-3-carboxylate

Systemtic Name: ethyl (4Z)-6-bromanyl-2-methyl-5-oxidanylidene-4-(phenylhydrazinylidene)-1-(phenylmethyl)indole-3-carboxylate Openeye Name: ethyl (4Z)-1-benzyl-6-bromo-2-methyl-5-oxo-4-(phenylhydrazono)indole-3-carboxylate CAS Name: (4Z)-6-bromo-2-methyl-5-oxo-4-(phenylhydrazinylidene)-1-(phenylmethyl)-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl (4Z)-1-benzyl-6-bromo-2-methyl-5-oxo-4-(phenylhydrazinylidene)indole-3-carboxylate Traditional Name: (4Z)-1-benzyl-6-bromo-5-keto-2-methyl-4-(phenylhydrazono)indole-3-carboxylic acid ethyl ester Formula: C25H22BrN3O3 MolecularWeight: 492.36448

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C1C(=NNC3=CC=CC=C3)C(=O)C(=C2)Br)CC4=CC=CC=C4)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C1/C(=N/NC3=CC=CC=C3)/C(=O)C(=C2)Br)CC4=CC=CC=C4)C

InChI

InChI=1S/C25H22BrN3O3/c1-3-32-25(31)21-16(2)29(15-17-10-6-4-7-11-17)20-14-19(26)24(30)23(22(20)21)28-27-18-12-8-5-9-13-18/h4-14,27H,3,15H2,1-2H3/b28-23-