ethyl 2-[3-(ethylamino)-6-ethylimino-2,7-dimethyl-1,4-dihydroxanthen-9-yl]cyclohexane-1-carboxylate

Systemtic Name: ethyl 2-[3-(ethylamino)-6-ethylimino-2,7-dimethyl-1,4-dihydroxanthen-9-yl]cyclohexane-1-carboxylate Openeye Name: ethyl 2-[3-(ethylamino)-6-ethylimino-2,7-dimethyl-1,4-dihydroxanthen-9-yl]cyclohexanecarboxylate CAS Name: 2-[3-(ethylamino)-6-ethylimino-2,7-dimethyl-1,4-dihydroxanthen-9-yl]-1-cyclohexanecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[3-(ethylamino)-6-ethylimino-2,7-dimethyl-1,4-dihydroxanthen-9-yl]cyclohexane-1-carboxylate Traditional Name: 2-[3-(ethylamino)-6-ethylimino-2,7-dimethyl-1,4-dihydroxanthen-9-yl]cyclohexanecarboxylic acid ethyl ester Formula: C28H38N2O3 MolecularWeight: 450.61292

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(CC2=C(C1)OC3=CC(=NCC)C(=CC3=C2C4CCCCC4C(=O)OCC)C)C

Isomeric SMILES

CCNC1=C(CC2=C(C1)OC3=CC(=NCC)C(=CC3=C2C4CCCCC4C(=O)OCC)C)C

InChI

InChI=1S/C28H38N2O3/c1-6-29-23-15-25-21(13-17(23)4)27(19-11-9-10-12-20(19)28(31)32-8-3)22-14-18(5)24(30-7-2)16-26(22)33-25/h13,15,19-20,30H,6-12,14,16H2,1-5H3