(3-ethyl-2,4,5,6-tetrahydro-1H-azepino[4,5-b]indol-5-yl)methyl benzoate

Systemtic Name: (3-ethyl-2,4,5,6-tetrahydro-1H-azepino[4,5-b]indol-5-yl)methyl benzoate Openeye Name: (3-ethyl-2,4,5,6-tetrahydro-1H-azepino[4,5-b]indol-5-yl)methyl benzoate CAS Name: benzoic acid (3-ethyl-2,4,5,6-tetrahydro-1H-azepino[4,5-b]indol-5-yl)methyl ester IUPAC Name: (3-ethyl-2,4,5,6-tetrahydro-1H-azepino[4,5-b]indol-5-yl)methyl benzoate Traditional Name: benzoic acid (3-ethyl-2,4,5,6-tetrahydro-1H-azepin[4,5-b]indol-5-yl)methyl ester Formula: C22H24N2O2 MolecularWeight: 348.43816

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCC2=C(C(C1)COC(=O)C3=CC=CC=C3)NC4=CC=CC=C24

Isomeric SMILES

CCN1CCC2=C(C(C1)COC(=O)C3=CC=CC=C3)NC4=CC=CC=C24

InChI

InChI=1S/C22H24N2O2/c1-2-24-13-12-19-18-10-6-7-11-20(18)23-21(19)17(14-24)15-26-22(25)16-8-4-3-5-9-16/h3-11,17,23H,2,12-15H2,1H3