N-[1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-oxidanylidene-6-(phenylcarbamoylamino)hexan-2-yl]tetradecanamide

Systemtic Name: N-[1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-oxidanylidene-6-(phenylcarbamoylamino)hexan-2-yl]tetradecanamide Openeye Name: N-[1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)-5-(phenylcarbamoylamino)pentyl]tetradecanamide CAS Name: N-[6-[[anilino(oxo)methyl]amino]-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-oxohexan-2-yl]tetradecanamide IUPAC Name: N-[1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-oxo-6-(phenylcarbamoylamino)hexan-2-yl]tetradecanamide Traditional Name: N-[1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)-5-(phenylcarbamoylamino)pentyl]myristamide Formula: C38H58N4O5 MolecularWeight: 650.89092

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(=O)NC(CCCCNC(=O)NC1=CC=CC=C1)C(=O)N2CCC3=CC(=C(C=C3C2)OC)OC

Isomeric SMILES

CCCCCCCCCCCCCC(=O)NC(CCCCNC(=O)NC1=CC=CC=C1)C(=O)N2CCC3=CC(=C(C=C3C2)OC)OC

InChI

InChI=1S/C38H58N4O5/c1-4-5-6-7-8-9-10-11-12-13-17-23-36(43)41-33(22-18-19-25-39-38(45)40-32-20-15-14-16-21-32)37(44)42-26-24-30-27-34(46-2)35(47-3)28-31(30)29-42/h14-16,20-21,27-28,33H,4-13,17-19,22-26,29H2,1-3H3,(H,41,43)(H2,39,40,45)