5-[2-(4-chloranylphenoxy)ethanoylamino]-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-ethoxypropyl)benzamide

Systemtic Name: 5-[2-(4-chloranylphenoxy)ethanoylamino]-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-ethoxypropyl)benzamide Openeye Name: 5-[[2-(4-chlorophenoxy)acetyl]amino]-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-ethoxypropyl)benzamide CAS Name: 5-[[2-(4-chlorophenoxy)-1-oxoethyl]amino]-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-ethoxypropyl)benzamide IUPAC Name: 5-[[2-(4-chlorophenoxy)acetyl]amino]-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-ethoxypropyl)benzamide Traditional Name: 5-[[2-(4-chlorophenoxy)acetyl]amino]-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-ethoxypropyl)benzamide Formula: C29H32ClN3O4 MolecularWeight: 522.03508

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=O)C1=C(C=CC(=C1)NC(=O)COC2=CC=C(C=C2)Cl)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CCOCCCNC(=O)C1=C(C=CC(=C1)NC(=O)COC2=CC=C(C=C2)Cl)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C29H32ClN3O4/c1-2-36-17-5-15-31-29(35)26-18-24(32-28(34)20-37-25-11-8-23(30)9-12-25)10-13-27(26)33-16-14-21-6-3-4-7-22(21)19-33/h3-4,6-13,18H,2,5,14-17,19-20H2,1H3,(H,31,35)(H,32,34)