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3-[3-(ethylamino)-6-ethylimino-2,7-dimethyl-xanthen-9-yl]propanoic acid

3-[3-(ethylamino)-6-ethylimino-2,7-dimethyl-xanthen-9-yl]propanoic acid

Systemtic Name:3-[3-(ethylamino)-6-ethylimino-2,7-dimethyl-xanthen-9-yl]propanoic acid
Openeye Name:3-[3-(ethylamino)-6-ethylimino-2,7-dimethyl-xanthen-9-yl]propanoic acid
CAS Name:3-[3-(ethylamino)-6-ethylimino-2,7-dimethyl-9-xanthenyl]propanoic acid
IUPAC Name:3-[3-(ethylamino)-6-ethylimino-2,7-dimethylxanthen-9-yl]propanoic acid
Traditional Name:3-[3-(ethylamino)-6-ethylimino-2,7-dimethyl-xanthen-9-yl]propionic acid
Formula: C22H26N2O3
MolecularWeight: 366.45344
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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C=C2C(=C1)OC3=CC(=NCC)C(=CC3=C2CCC(=O)O)C)C


Isomeric SMILES

CCNC1=C(C=C2C(=C1)OC3=CC(=NCC)C(=CC3=C2CCC(=O)O)C)C


InChI

InChI=1S/C22H26N2O3/c1-5-23-18-11-20-16(9-13(18)3)15(7-8-22(25)26)17-10-14(4)19(24-6-2)12-21(17)27-20/h9-12,23H,5-8H2,1-4H3,(H,25,26)


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