2-azanyl-2-[2-[2-(3-butylisoquinolin-1-yl)oxyethyl-methyl-amino]ethanoyl]-4-methyl-pentanal

Systemtic Name: 2-azanyl-2-[2-[2-(3-butylisoquinolin-1-yl)oxyethyl-methyl-amino]ethanoyl]-4-methyl-pentanal Openeye Name: 2-amino-2-[2-[2-[(3-butyl-1-isoquinolyl)oxy]ethyl-methyl-amino]acetyl]-4-methyl-pentanal CAS Name: 2-amino-2-[2-[2-[(3-butyl-1-isoquinolinyl)oxy]ethyl-methylamino]-1-oxoethyl]-4-methylpentanal IUPAC Name: 2-amino-2-[2-[2-(3-butylisoquinolin-1-yl)oxyethyl-methylamino]acetyl]-4-methylpentanal Traditional Name: 2-amino-2-[2-[2-[(3-butyl-1-isoquinolyl)oxy]ethyl-methyl-amino]acetyl]-4-methyl-valeraldehyde Formula: C24H35N3O3 MolecularWeight: 413.553

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=CC=CC=C2C(=N1)OCCN(C)CC(=O)C(CC(C)C)(C=O)N

Isomeric SMILES

CCCCC1=CC2=CC=CC=C2C(=N1)OCCN(C)CC(=O)C(CC(C)C)(C=O)N

InChI

InChI=1S/C24H35N3O3/c1-5-6-10-20-14-19-9-7-8-11-21(19)23(26-20)30-13-12-27(4)16-22(29)24(25,17-28)15-18(2)3/h7-9,11,14,17-18H,5-6,10,12-13,15-16,25H2,1-4H3