2-[(2,2-dimethyl-1H-benzo[f]isoquinolin-4-yl)amino]-4-methyl-pentanoic acid

Systemtic Name: 2-[(2,2-dimethyl-1H-benzo[f]isoquinolin-4-yl)amino]-4-methyl-pentanoic acid Openeye Name: 2-[(2,2-dimethyl-1H-benzo[f]isoquinolin-4-yl)amino]-4-methyl-pentanoic acid CAS Name: 2-[(2,2-dimethyl-1H-benzo[f]isoquinolin-4-yl)amino]-4-methylpentanoic acid IUPAC Name: 2-[(2,2-dimethyl-1H-benzo[f]isoquinolin-4-yl)amino]-4-methylpentanoic acid Traditional Name: 2-[(2,2-dimethyl-1H-benz[f]isoquinolin-4-yl)amino]-4-methyl-valeric acid Formula: C21H26N2O2 MolecularWeight: 338.44334

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NC1=NC(CC2=C1C=CC3=CC=CC=C23)(C)C

Isomeric SMILES

CC(C)CC(C(=O)O)NC1=NC(CC2=C1C=CC3=CC=CC=C23)(C)C

InChI

InChI=1S/C21H26N2O2/c1-13(2)11-18(20(24)25)22-19-16-10-9-14-7-5-6-8-15(14)17(16)12-21(3,4)23-19/h5-10,13,18H,11-12H2,1-4H3,(H,22,23)(H,24,25)