ethyl 4-(1,2,3,4,4a,10b-hexahydrophenanthridin-1-yl)cyclohexane-1-carboxylate

Systemtic Name: ethyl 4-(1,2,3,4,4a,10b-hexahydrophenanthridin-1-yl)cyclohexane-1-carboxylate Openeye Name: ethyl 4-(1,2,3,4,4a,10b-hexahydrophenanthridin-1-yl)cyclohexanecarboxylate CAS Name: 4-(1,2,3,4,4a,10b-hexahydrophenanthridin-1-yl)-1-cyclohexanecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(1,2,3,4,4a,10b-hexahydrophenanthridin-1-yl)cyclohexane-1-carboxylate Traditional Name: 4-(1,2,3,4,4a,10b-hexahydrophenanthridin-1-yl)cyclohexanecarboxylic acid ethyl ester Formula: C22H29NO2 MolecularWeight: 339.47116

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCC(CC1)C2CCCC3C2C4=CC=CC=C4C=N3

Isomeric SMILES

CCOC(=O)C1CCC(CC1)C2CCCC3C2C4=CC=CC=C4C=N3

InChI

InChI=1S/C22H29NO2/c1-2-25-22(24)16-12-10-15(11-13-16)18-8-5-9-20-21(18)19-7-4-3-6-17(19)14-23-20/h3-4,6-7,14-16,18,20-21H,2,5,8-13H2,1H3