ethyl 5-oxidanyl-3-oxidanylidene-7-(1-phenyl-3-propan-2-yl-pyrrolo[2,1-a]isoquinolin-2-yl)heptanoate

Systemtic Name: ethyl 5-oxidanyl-3-oxidanylidene-7-(1-phenyl-3-propan-2-yl-pyrrolo[2,1-a]isoquinolin-2-yl)heptanoate Openeye Name: ethyl 5-hydroxy-7-(3-isopropyl-1-phenyl-pyrrolo[2,1-a]isoquinolin-2-yl)-3-oxo-heptanoate CAS Name: 5-hydroxy-3-oxo-7-(1-phenyl-3-propan-2-yl-2-pyrrolo[2,1-a]isoquinolinyl)heptanoic acid ethyl ester IUPAC Name: ethyl 5-hydroxy-3-oxo-7-(1-phenyl-3-propan-2-ylpyrrolo[2,1-a]isoquinolin-2-yl)heptanoate Traditional Name: 5-hydroxy-7-(3-isopropyl-1-phenyl-pyrrol[2,1-a]isoquinolin-2-yl)-3-keto-enanthic acid ethyl ester Formula: C30H33NO4 MolecularWeight: 471.58732

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=O)CC(CCC1=C(N2C=CC3=CC=CC=C3C2=C1C4=CC=CC=C4)C(C)C)O

Isomeric SMILES

CCOC(=O)CC(=O)CC(CCC1=C(N2C=CC3=CC=CC=C3C2=C1C4=CC=CC=C4)C(C)C)O

InChI

InChI=1S/C30H33NO4/c1-4-35-27(34)19-24(33)18-23(32)14-15-26-28(22-11-6-5-7-12-22)30-25-13-9-8-10-21(25)16-17-31(30)29(26)20(2)3/h5-13,16-17,20,23,32H,4,14-15,18-19H2,1-3H3