ethyl 7-bromanyl-2-methyl-4-oxidanylidene-3-(phenylmethyl)indeno[2,1-b]pyrrole-1-carboxylate

Systemtic Name: ethyl 7-bromanyl-2-methyl-4-oxidanylidene-3-(phenylmethyl)indeno[2,1-b]pyrrole-1-carboxylate Openeye Name: ethyl 3-benzyl-7-bromo-2-methyl-4-oxo-indeno[2,1-b]pyrrole-1-carboxylate CAS Name: 7-bromo-2-methyl-4-oxo-3-(phenylmethyl)-1-indeno[2,1-b]pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-benzyl-7-bromo-2-methyl-4-oxoindeno[2,1-b]pyrrole-1-carboxylate Traditional Name: 3-benzyl-7-bromo-4-keto-2-methyl-indeno[2,1-b]pyrrole-1-carboxylic acid ethyl ester Formula: C22H18BrNO3 MolecularWeight: 424.28722

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C1C3=C(C2=O)C=CC(=C3)Br)CC4=CC=CC=C4)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C1C3=C(C2=O)C=CC(=C3)Br)CC4=CC=CC=C4)C

InChI

InChI=1S/C22H18BrNO3/c1-3-27-22(26)18-13(2)24(12-14-7-5-4-6-8-14)20-19(18)17-11-15(23)9-10-16(17)21(20)25/h4-11H,3,12H2,1-2H3