3-(aminomethyl)-6-ethoxy-2-(2-methylpropyl)-4-phenyl-isoquinolin-1-one

Systemtic Name: 3-(aminomethyl)-6-ethoxy-2-(2-methylpropyl)-4-phenyl-isoquinolin-1-one Openeye Name: 3-(aminomethyl)-6-ethoxy-2-isobutyl-4-phenyl-isoquinolin-1-one CAS Name: 3-(aminomethyl)-6-ethoxy-2-(2-methylpropyl)-4-phenyl-1-isoquinolinone IUPAC Name: 3-(aminomethyl)-6-ethoxy-2-(2-methylpropyl)-4-phenylisoquinolin-1-one Traditional Name: 3-(aminomethyl)-6-ethoxy-2-isobutyl-4-phenyl-isocarbostyril Formula: C22H26N2O2 MolecularWeight: 350.45404

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)C(=O)N(C(=C2C3=CC=CC=C3)CN)CC(C)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)C(=O)N(C(=C2C3=CC=CC=C3)CN)CC(C)C

InChI

InChI=1S/C22H26N2O2/c1-4-26-17-10-11-18-19(12-17)21(16-8-6-5-7-9-16)20(13-23)24(22(18)25)14-15(2)3/h5-12,15H,4,13-14,23H2,1-3H3