N-[4-(3-methylbutanoylamino)phenyl]-9H-xanthene-9-carboxamide

Systemtic Name: N-[4-(3-methylbutanoylamino)phenyl]-9H-xanthene-9-carboxamide Openeye Name: N-[4-(3-methylbutanoylamino)phenyl]-9H-xanthene-9-carboxamide CAS Name: N-[4-[(3-methyl-1-oxobutyl)amino]phenyl]-9H-xanthene-9-carboxamide IUPAC Name: N-[4-(3-methylbutanoylamino)phenyl]-9H-xanthene-9-carboxamide Traditional Name: N-[4-(isovalerylamino)phenyl]-9H-xanthene-9-carboxamide Formula: C25H24N2O3 MolecularWeight: 400.46966

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC=C(C=C1)NC(=O)C2C3=CC=CC=C3OC4=CC=CC=C24

Isomeric SMILES

CC(C)CC(=O)NC1=CC=C(C=C1)NC(=O)C2C3=CC=CC=C3OC4=CC=CC=C24

InChI

InChI=1S/C25H24N2O3/c1-16(2)15-23(28)26-17-11-13-18(14-12-17)27-25(29)24-19-7-3-5-9-21(19)30-22-10-6-4-8-20(22)24/h3-14,16,24H,15H2,1-2H3,(H,26,28)(H,27,29)