ethyl 4-[4-(aminomethyl)-6,7-dimethoxy-1-oxidanylidene-isoquinolin-2-yl]butanoate

Systemtic Name: ethyl 4-[4-(aminomethyl)-6,7-dimethoxy-1-oxidanylidene-isoquinolin-2-yl]butanoate Openeye Name: ethyl 4-[4-(aminomethyl)-6,7-dimethoxy-1-oxo-2-isoquinolyl]butanoate CAS Name: 4-[4-(aminomethyl)-6,7-dimethoxy-1-oxo-2-isoquinolinyl]butanoic acid ethyl ester IUPAC Name: ethyl 4-[4-(aminomethyl)-6,7-dimethoxy-1-oxoisoquinolin-2-yl]butanoate Traditional Name: 4-[4-(aminomethyl)-1-keto-6,7-dimethoxy-2-isoquinolyl]butyric acid ethyl ester Formula: C18H24N2O5 MolecularWeight: 348.39356

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCN1C=C(C2=CC(=C(C=C2C1=O)OC)OC)CN

Isomeric SMILES

CCOC(=O)CCCN1C=C(C2=CC(=C(C=C2C1=O)OC)OC)CN

InChI

InChI=1S/C18H24N2O5/c1-4-25-17(21)6-5-7-20-11-12(10-19)13-8-15(23-2)16(24-3)9-14(13)18(20)22/h8-9,11H,4-7,10,19H2,1-3H3