[4-[[2-(3-butylisoquinolin-1-yl)oxyethyl-methyl-amino]methyl]-1-[4-[3-(ethylamino)propoxy]phenyl]pyrrolidin-2-ylidene]methanone

Systemtic Name: [4-[[2-(3-butylisoquinolin-1-yl)oxyethyl-methyl-amino]methyl]-1-[4-[3-(ethylamino)propoxy]phenyl]pyrrolidin-2-ylidene]methanone Openeye Name: [4-[[2-[(3-butyl-1-isoquinolyl)oxy]ethyl-methyl-amino]methyl]-1-[4-[3-(ethylamino)propoxy]phenyl]pyrrolidin-2-ylidene]methanone CAS Name: [4-[[2-[(3-butyl-1-isoquinolinyl)oxy]ethyl-methylamino]methyl]-1-[4-[3-(ethylamino)propoxy]phenyl]-2-pyrrolidinylidene]methanone IUPAC Name: [4-[[2-(3-butylisoquinolin-1-yl)oxyethyl-methylamino]methyl]-1-[4-[3-(ethylamino)propoxy]phenyl]pyrrolidin-2-ylidene]methanone Traditional Name: [4-[[2-[(3-butyl-1-isoquinolyl)oxy]ethyl-methyl-amino]methyl]-1-[4-[3-(ethylamino)propoxy]phenyl]pyrrolidin-2-ylidene]methanone Formula: C33H44N4O3 MolecularWeight: 544.72746

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=CC=CC=C2C(=N1)OCCN(C)CC3CC(=C=O)N(C3)C4=CC=C(C=C4)OCCCNCC

Isomeric SMILES

CCCCC1=CC2=CC=CC=C2C(=N1)OCCN(C)CC3CC(=C=O)N(C3)C4=CC=C(C=C4)OCCCNCC

InChI

InChI=1S/C33H44N4O3/c1-4-6-11-28-22-27-10-7-8-12-32(27)33(35-28)40-20-18-36(3)23-26-21-30(25-38)37(24-26)29-13-15-31(16-14-29)39-19-9-17-34-5-2/h7-8,10,12-16,22,26,34H,4-6,9,11,17-21,23-24H2,1-3H3