ethyl 2-(6-oxidanylidene-4,5,7,8-tetrahydro-1H-pyrrolo[2,3-c]azepin-3-yl)ethanoate

Systemtic Name: ethyl 2-(6-oxidanylidene-4,5,7,8-tetrahydro-1H-pyrrolo[2,3-c]azepin-3-yl)ethanoate Openeye Name: ethyl 2-(6-oxo-4,5,7,8-tetrahydro-1H-pyrrolo[2,3-c]azepin-3-yl)acetate CAS Name: 2-(6-oxo-4,5,7,8-tetrahydro-1H-pyrrolo[2,3-c]azepin-3-yl)acetic acid ethyl ester IUPAC Name: ethyl 2-(6-oxo-4,5,7,8-tetrahydro-1H-pyrrolo[2,3-c]azepin-3-yl)acetate Traditional Name: 2-(6-keto-4,5,7,8-tetrahydro-1H-pyrrol[2,3-c]azepin-3-yl)acetic acid ethyl ester Formula: C12H16N2O3 MolecularWeight: 236.26704

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CNC2=C1CCC(=O)NC2

Isomeric SMILES

CCOC(=O)CC1=CNC2=C1CCC(=O)NC2

InChI

InChI=1S/C12H16N2O3/c1-2-17-12(16)5-8-6-13-10-7-14-11(15)4-3-9(8)10/h6,13H,2-5,7H2,1H3,(H,14,15)