[2-(azepan-1-yl)-2-oxidanylidene-ethyl] 6,7,8,9-tetrahydro-5H-carbazole-3-carboxylate

Systemtic Name: [2-(azepan-1-yl)-2-oxidanylidene-ethyl] 6,7,8,9-tetrahydro-5H-carbazole-3-carboxylate Openeye Name: [2-(azepan-1-yl)-2-oxo-ethyl] 6,7,8,9-tetrahydro-5H-carbazole-3-carboxylate CAS Name: 6,7,8,9-tetrahydro-5H-carbazole-3-carboxylic acid [2-(1-azepanyl)-2-oxoethyl] ester IUPAC Name: [2-(azepan-1-yl)-2-oxoethyl] 6,7,8,9-tetrahydro-5H-carbazole-3-carboxylate Traditional Name: 6,7,8,9-tetrahydro-5H-carbazole-3-carboxylic acid [2-(azepan-1-yl)-2-keto-ethyl] ester Formula: C21H26N2O3 MolecularWeight: 354.44274

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)COC(=O)C2=CC3=C(C=C2)NC4=C3CCCC4

Isomeric SMILES

C1CCCN(CC1)C(=O)COC(=O)C2=CC3=C(C=C2)NC4=C3CCCC4

InChI

InChI=1S/C21H26N2O3/c24-20(23-11-5-1-2-6-12-23)14-26-21(25)15-9-10-19-17(13-15)16-7-3-4-8-18(16)22-19/h9-10,13,22H,1-8,11-12,14H2