2-(azepan-1-yl)ethyl anthracene-9-carboxylate

Systemtic Name: 2-(azepan-1-yl)ethyl anthracene-9-carboxylate Openeye Name: 2-(azepan-1-yl)ethyl anthracene-9-carboxylate CAS Name: 9-anthracenecarboxylic acid 2-(1-azepanyl)ethyl ester IUPAC Name: 2-(azepan-1-yl)ethyl anthracene-9-carboxylate Traditional Name: anthracene-9-carboxylic acid 2-(azepan-1-yl)ethyl ester Formula: C23H25NO2 MolecularWeight: 347.4501

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CCOC(=O)C2=C3C=CC=CC3=CC4=CC=CC=C42

Isomeric SMILES

C1CCCN(CC1)CCOC(=O)C2=C3C=CC=CC3=CC4=CC=CC=C42

InChI

InChI=1S/C23H25NO2/c25-23(26-16-15-24-13-7-1-2-8-14-24)22-20-11-5-3-9-18(20)17-19-10-4-6-12-21(19)22/h3-6,9-12,17H,1-2,7-8,13-16H2