2,7-bis[4-(ditert-butylamino)butanoyl]xanthen-9-one

Systemtic Name: 2,7-bis[4-(ditert-butylamino)butanoyl]xanthen-9-one Openeye Name: 2,7-bis[4-(ditert-butylamino)butanoyl]xanthen-9-one CAS Name: 2,7-bis[4-(ditert-butylamino)-1-oxobutyl]-9-xanthenone IUPAC Name: 2,7-bis[4-(ditert-butylamino)butanoyl]xanthen-9-one Traditional Name: 2,7-bis[4-(ditert-butylamino)butanoyl]xanthone Formula: C37H54N2O4 MolecularWeight: 590.83566

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C37H54N2O4/c1-34(2,3)38(35(4,5)6)21-13-15-29(40)25-17-19-31-27(23-25)33(42)28-24-26(18-20-32(28)43-31)30(41)16-14-22-39(36(7,8)9)37(10,11)12/h17-20,23-24H,13-16,21-22H2,1-12H3