ethyl 2-[6-(ethylamino)-2,3,7-trimethyl-3H-xanthen-9-yl]benzoate

Systemtic Name: ethyl 2-[6-(ethylamino)-2,3,7-trimethyl-3H-xanthen-9-yl]benzoate Openeye Name: ethyl 2-[6-(ethylamino)-2,3,7-trimethyl-3H-xanthen-9-yl]benzoate CAS Name: 2-[6-(ethylamino)-2,3,7-trimethyl-3H-xanthen-9-yl]benzoic acid ethyl ester IUPAC Name: ethyl 2-[6-(ethylamino)-2,3,7-trimethyl-3H-xanthen-9-yl]benzoate Traditional Name: 2-[6-(ethylamino)-2,3,7-trimethyl-3H-xanthen-9-yl]benzoic acid ethyl ester Formula: C27H29NO3 MolecularWeight: 415.52406

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C=C2C(=C1)OC3=CC(C(=CC3=C2C4=CC=CC=C4C(=O)OCC)C)C)C

Isomeric SMILES

CCNC1=C(C=C2C(=C1)OC3=CC(C(=CC3=C2C4=CC=CC=C4C(=O)OCC)C)C)C

InChI

InChI=1S/C27H29NO3/c1-6-28-23-15-25-22(13-18(23)5)26(21-12-16(3)17(4)14-24(21)31-25)19-10-8-9-11-20(19)27(29)30-7-2/h8-15,17,28H,6-7H2,1-5H3