methyl 4-oxidanylidene-2-phenyl-spiro[1,2,5,6-tetrahydro-1-benzazocine-3,1'-cyclopropane]-8-carboxylate

Systemtic Name: methyl 4-oxidanylidene-2-phenyl-spiro[1,2,5,6-tetrahydro-1-benzazocine-3,1'-cyclopropane]-8-carboxylate Openeye Name: methyl 4-oxo-2-phenyl-spiro[1,2,5,6-tetrahydro-1-benzazocine-3,1'-cyclopropane]-8-carboxylate CAS Name: 4-oxo-2-phenyl-8-spiro[1,2,5,6-tetrahydro-1-benzazocine-3,1'-cyclopropane]carboxylic acid methyl ester IUPAC Name: methyl 4-oxo-2-phenylspiro[1,2,5,6-tetrahydro-1-benzazocine-3,1'-cyclopropane]-8-carboxylate Traditional Name: 4-keto-2-phenyl-spiro[1,2,5,6-tetrahydro-1-benzazocine-3,1'-cyclopropane]-8-carboxylic acid methyl ester Formula: C21H21NO3 MolecularWeight: 335.39634

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)NC(C3(CC3)C(=O)CC2)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)NC(C3(CC3)C(=O)CC2)C4=CC=CC=C4

InChI

InChI=1S/C21H21NO3/c1-25-20(24)16-7-9-17-15(13-16)8-10-18(23)21(11-12-21)19(22-17)14-5-3-2-4-6-14/h2-7,9,13,19,22H,8,10-12H2,1H3