N-(2-diethylaminoethyl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-(2-phenylmethoxyethanoylamino)benzamide

Systemtic Name: N-(2-diethylaminoethyl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-(2-phenylmethoxyethanoylamino)benzamide Openeye Name: 5-[(2-benzyloxyacetyl)amino]-N-(2-diethylaminoethyl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)benzamide CAS Name: N-(2-diethylaminoethyl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(1-oxo-2-phenylmethoxyethyl)amino]benzamide IUPAC Name: N-(2-diethylaminoethyl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(2-phenylmethoxyacetyl)amino]benzamide Traditional Name: 5-[(2-benzoxyacetyl)amino]-N-(2-diethylaminoethyl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)benzamide Formula: C31H38N4O3 MolecularWeight: 514.65842

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(=O)C1=C(C=CC(=C1)NC(=O)COCC2=CC=CC=C2)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CCN(CC)CCNC(=O)C1=C(C=CC(=C1)NC(=O)COCC2=CC=CC=C2)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C31H38N4O3/c1-3-34(4-2)19-17-32-31(37)28-20-27(33-30(36)23-38-22-24-10-6-5-7-11-24)14-15-29(28)35-18-16-25-12-8-9-13-26(25)21-35/h5-15,20H,3-4,16-19,21-23H2,1-2H3,(H,32,37)(H,33,36)