2-methyl-2-[5-(2-methylpropanoyl)-6H-phenanthridin-6-yl]propanoic acid

Systemtic Name: 2-methyl-2-[5-(2-methylpropanoyl)-6H-phenanthridin-6-yl]propanoic acid Openeye Name: 2-methyl-2-[5-(2-methylpropanoyl)-6H-phenanthridin-6-yl]propanoic acid CAS Name: 2-methyl-2-[5-(2-methyl-1-oxopropyl)-6H-phenanthridin-6-yl]propanoic acid IUPAC Name: 2-methyl-2-[5-(2-methylpropanoyl)-6H-phenanthridin-6-yl]propanoic acid Traditional Name: 2-(5-isobutyryl-6H-phenanthridin-6-yl)-2-methyl-propionic acid Formula: C21H23NO3 MolecularWeight: 337.41222

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1C(C2=CC=CC=C2C3=CC=CC=C31)C(C)(C)C(=O)O

Isomeric SMILES

CC(C)C(=O)N1C(C2=CC=CC=C2C3=CC=CC=C31)C(C)(C)C(=O)O

InChI

InChI=1S/C21H23NO3/c1-13(2)19(23)22-17-12-8-7-10-15(17)14-9-5-6-11-16(14)18(22)21(3,4)20(24)25/h5-13,18H,1-4H3,(H,24,25)