methyl 2-oxidanylidene-1-(phenylmethyl)-4,5,6,7-tetrahydrocyclohepta[b]pyrrole-3-carboxylate

Systemtic Name: methyl 2-oxidanylidene-1-(phenylmethyl)-4,5,6,7-tetrahydrocyclohepta[b]pyrrole-3-carboxylate Openeye Name: methyl 1-benzyl-2-oxo-4,5,6,7-tetrahydrocyclohepta[b]pyrrole-3-carboxylate CAS Name: 2-oxo-1-(phenylmethyl)-4,5,6,7-tetrahydrocyclohepta[b]pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 1-benzyl-2-oxo-4,5,6,7-tetrahydrocyclohepta[b]pyrrole-3-carboxylate Traditional Name: 1-benzyl-2-keto-4,5,6,7-tetrahydrocyclohepta[b]pyrrole-3-carboxylic acid methyl ester Formula: C18H19NO3 MolecularWeight: 297.34836

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C2CCCCC=C2N(C1=O)CC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=C2CCCCC=C2N(C1=O)CC3=CC=CC=C3

InChI

InChI=1S/C18H19NO3/c1-22-18(21)16-14-10-6-3-7-11-15(14)19(17(16)20)12-13-8-4-2-5-9-13/h2,4-5,8-9,11H,3,6-7,10,12H2,1H3