2-(7-azanyl-3,4,5,6-tetrahydro-2H-azepin-6-yl)ethyl benzoate

Systemtic Name: 2-(7-azanyl-3,4,5,6-tetrahydro-2H-azepin-6-yl)ethyl benzoate Openeye Name: 2-(7-amino-3,4,5,6-tetrahydro-2H-azepin-6-yl)ethyl benzoate CAS Name: benzoic acid 2-(7-amino-3,4,5,6-tetrahydro-2H-azepin-6-yl)ethyl ester IUPAC Name: 2-(7-amino-3,4,5,6-tetrahydro-2H-azepin-6-yl)ethyl benzoate Traditional Name: benzoic acid 2-(7-amino-3,4,5,6-tetrahydro-2H-azepin-6-yl)ethyl ester Formula: C15H20N2O2 MolecularWeight: 260.3315

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN=C(C(C1)CCOC(=O)C2=CC=CC=C2)N

Isomeric SMILES

C1CCN=C(C(C1)CCOC(=O)C2=CC=CC=C2)N

InChI

InChI=1S/C15H20N2O2/c16-14-12(6-4-5-10-17-14)9-11-19-15(18)13-7-2-1-3-8-13/h1-3,7-8,12H,4-6,9-11H2,(H2,16,17)