3-(aminomethyl)-4-butoxy-2-(2,2-dimethylpropyl)benzo[g]isoquinolin-1-one

Systemtic Name: 3-(aminomethyl)-4-butoxy-2-(2,2-dimethylpropyl)benzo[g]isoquinolin-1-one Openeye Name: 3-(aminomethyl)-4-butoxy-2-(2,2-dimethylpropyl)benzo[g]isoquinolin-1-one CAS Name: 3-(aminomethyl)-4-butoxy-2-(2,2-dimethylpropyl)-1-benzo[g]isoquinolinone IUPAC Name: 3-(aminomethyl)-4-butoxy-2-(2,2-dimethylpropyl)benzo[g]isoquinolin-1-one Traditional Name: 3-(aminomethyl)-4-butoxy-2-neopentyl-benz[g]isoquinolin-1-one Formula: C23H30N2O2 MolecularWeight: 366.4965

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(N(C(=O)C2=CC3=CC=CC=C3C=C21)CC(C)(C)C)CN

Isomeric SMILES

CCCCOC1=C(N(C(=O)C2=CC3=CC=CC=C3C=C21)CC(C)(C)C)CN

InChI

InChI=1S/C23H30N2O2/c1-5-6-11-27-21-18-12-16-9-7-8-10-17(16)13-19(18)22(26)25(20(21)14-24)15-23(2,3)4/h7-10,12-13H,5-6,11,14-15,24H2,1-4H3