2-(azepan-1-yl)ethyl 9-[(4-methoxyphenyl)methyl]fluorene-9-carboxylate

Systemtic Name: 2-(azepan-1-yl)ethyl 9-[(4-methoxyphenyl)methyl]fluorene-9-carboxylate Openeye Name: 2-(azepan-1-yl)ethyl 9-[(4-methoxyphenyl)methyl]fluorene-9-carboxylate CAS Name: 9-[(4-methoxyphenyl)methyl]-9-fluorenecarboxylic acid 2-(1-azepanyl)ethyl ester IUPAC Name: 2-(azepan-1-yl)ethyl 9-[(4-methoxyphenyl)methyl]fluorene-9-carboxylate Traditional Name: 9-p-anisylfluorene-9-carboxylic acid 2-(azepan-1-yl)ethyl ester Formula: C30H33NO3 MolecularWeight: 455.58792

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC2(C3=CC=CC=C3C4=CC=CC=C42)C(=O)OCCN5CCCCCC5

Isomeric SMILES

COC1=CC=C(C=C1)CC2(C3=CC=CC=C3C4=CC=CC=C42)C(=O)OCCN5CCCCCC5

InChI

InChI=1S/C30H33NO3/c1-33-24-16-14-23(15-17-24)22-30(29(32)34-21-20-31-18-8-2-3-9-19-31)27-12-6-4-10-25(27)26-11-5-7-13-28(26)30/h4-7,10-17H,2-3,8-9,18-22H2,1H3