N-(2-diethylaminoethyl)-4-[[5-(3-hydroxyphenyl)isoquinolin-1-yl]amino]benzamide

Systemtic Name: N-(2-diethylaminoethyl)-4-[[5-(3-hydroxyphenyl)isoquinolin-1-yl]amino]benzamide Openeye Name: N-(2-diethylaminoethyl)-4-[[5-(3-hydroxyphenyl)-1-isoquinolyl]amino]benzamide CAS Name: N-(2-diethylaminoethyl)-4-[[5-(3-hydroxyphenyl)-1-isoquinolinyl]amino]benzamide IUPAC Name: N-(2-diethylaminoethyl)-4-[[5-(3-hydroxyphenyl)isoquinolin-1-yl]amino]benzamide Traditional Name: N-(2-diethylaminoethyl)-4-[[5-(3-hydroxyphenyl)-1-isoquinolyl]amino]benzamide Formula: C28H30N4O2 MolecularWeight: 454.5634

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(=O)C1=CC=C(C=C1)NC2=NC=CC3=C2C=CC=C3C4=CC(=CC=C4)O

Isomeric SMILES

CCN(CC)CCNC(=O)C1=CC=C(C=C1)NC2=NC=CC3=C2C=CC=C3C4=CC(=CC=C4)O

InChI

InChI=1S/C28H30N4O2/c1-3-32(4-2)18-17-30-28(34)20-11-13-22(14-12-20)31-27-26-10-6-9-24(25(26)15-16-29-27)21-7-5-8-23(33)19-21/h5-16,19,33H,3-4,17-18H2,1-2H3,(H,29,31)(H,30,34)