methyl 4-spiro[3,5-dihydro-1H-2-benzazepine-4,3'-cyclohexene]-2-ylcarbonylbenzoate

Systemtic Name: methyl 4-spiro[3,5-dihydro-1H-2-benzazepine-4,3'-cyclohexene]-2-ylcarbonylbenzoate Openeye Name: methyl 4-(spiro[3,5-dihydro-1H-2-benzazepine-4,3'-cyclohexene]-2-carbonyl)benzoate CAS Name: 4-[oxo(2-spiro[3,5-dihydro-1H-2-benzazepine-4,3'-cyclohexene]yl)methyl]benzoic acid methyl ester IUPAC Name: methyl 4-(spiro[3,5-dihydro-1H-2-benzazepine-4,3'-cyclohexene]-2-carbonyl)benzoate Traditional Name: 4-(spiro[3,5-dihydro-1H-2-benzazepine-4,3'-cyclohexene]-2-carbonyl)benzoic acid methyl ester Formula: C24H25NO3 MolecularWeight: 375.4602

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(=O)N2CC3=CC=CC=C3CC4(C2)CCCC=C4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=O)N2CC3=CC=CC=C3CC4(C2)CCCC=C4

InChI

InChI=1S/C24H25NO3/c1-28-23(27)19-11-9-18(10-12-19)22(26)25-16-21-8-4-3-7-20(21)15-24(17-25)13-5-2-6-14-24/h3-5,7-13H,2,6,14-17H2,1H3