N-butan-2-yl-2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(3-methoxyphenyl)carbonylamino]benzamide

Systemtic Name: N-butan-2-yl-2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(3-methoxyphenyl)carbonylamino]benzamide Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(3-methoxybenzoyl)amino]-N-sec-butyl-benzamide CAS Name: N-butan-2-yl-2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[[(3-methoxyphenyl)-oxomethyl]amino]benzamide IUPAC Name: N-butan-2-yl-2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(3-methoxybenzoyl)amino]benzamide Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-(m-anisoylamino)-N-sec-butyl-benzamide Formula: C28H31N3O3 MolecularWeight: 457.56404

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=C(C=CC(=C1)NC(=O)C2=CC(=CC=C2)OC)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CCC(C)NC(=O)C1=C(C=CC(=C1)NC(=O)C2=CC(=CC=C2)OC)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C28H31N3O3/c1-4-19(2)29-28(33)25-17-23(30-27(32)21-10-7-11-24(16-21)34-3)12-13-26(25)31-15-14-20-8-5-6-9-22(20)18-31/h5-13,16-17,19H,4,14-15,18H2,1-3H3,(H,29,33)(H,30,32)