2-azanyl-1-[6-(2-azanyl-2-ethyl-butanoyl)-9H-xanthen-2-yl]-2-ethyl-butan-1-one

Systemtic Name: 2-azanyl-1-[6-(2-azanyl-2-ethyl-butanoyl)-9H-xanthen-2-yl]-2-ethyl-butan-1-one Openeye Name: 2-amino-1-[6-(2-amino-2-ethyl-butanoyl)-9H-xanthen-2-yl]-2-ethyl-butan-1-one CAS Name: 2-amino-1-[6-(2-amino-2-ethyl-1-oxobutyl)-9H-xanthen-2-yl]-2-ethyl-1-butanone IUPAC Name: 2-amino-1-[6-(2-amino-2-ethylbutanoyl)-9H-xanthen-2-yl]-2-ethylbutan-1-one Traditional Name: 2-amino-1-[6-(2-amino-2-ethyl-butanoyl)-9H-xanthen-2-yl]-2-ethyl-butan-1-one Formula: C25H32N2O3 MolecularWeight: 408.53318

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C(=O)C1=CC2=C(C=C1)OC3=C(C2)C=CC(=C3)C(=O)C(CC)(CC)N)N

Isomeric SMILES

CCC(CC)(C(=O)C1=CC2=C(C=C1)OC3=C(C2)C=CC(=C3)C(=O)C(CC)(CC)N)N

InChI

InChI=1S/C25H32N2O3/c1-5-24(26,6-2)22(28)17-11-12-20-19(14-17)13-16-9-10-18(15-21(16)30-20)23(29)25(27,7-3)8-4/h9-12,14-15H,5-8,13,26-27H2,1-4H3