N-[4-(3-oxidanylidene-4-propan-2-yl-2,4-dihydro-1H-isoquinolin-1-yl)phenyl]-4-pyrrolidin-1-yl-butanamide

Systemtic Name: N-[4-(3-oxidanylidene-4-propan-2-yl-2,4-dihydro-1H-isoquinolin-1-yl)phenyl]-4-pyrrolidin-1-yl-butanamide Openeye Name: N-[4-(4-isopropyl-3-oxo-2,4-dihydro-1H-isoquinolin-1-yl)phenyl]-4-pyrrolidin-1-yl-butanamide CAS Name: N-[4-(3-oxo-4-propan-2-yl-2,4-dihydro-1H-isoquinolin-1-yl)phenyl]-4-(1-pyrrolidinyl)butanamide IUPAC Name: N-[4-(3-oxo-4-propan-2-yl-2,4-dihydro-1H-isoquinolin-1-yl)phenyl]-4-pyrrolidin-1-ylbutanamide Traditional Name: N-[4-(4-isopropyl-3-keto-2,4-dihydro-1H-isoquinolin-1-yl)phenyl]-4-pyrrolidino-butyramide Formula: C26H33N3O2 MolecularWeight: 419.55912

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C2=CC=CC=C2C(NC1=O)C3=CC=C(C=C3)NC(=O)CCCN4CCCC4

Isomeric SMILES

CC(C)C1C2=CC=CC=C2C(NC1=O)C3=CC=C(C=C3)NC(=O)CCCN4CCCC4

InChI

InChI=1S/C26H33N3O2/c1-18(2)24-21-8-3-4-9-22(21)25(28-26(24)31)19-11-13-20(14-12-19)27-23(30)10-7-17-29-15-5-6-16-29/h3-4,8-9,11-14,18,24-25H,5-7,10,15-17H2,1-2H3,(H,27,30)(H,28,31)