[2-(3-butan-2-yloxyphenyl)-1-(6,7-dimethoxyisoquinolin-4-yl)-2-oxidanylidene-ethyl]carbamic acid

Systemtic Name: [2-(3-butan-2-yloxyphenyl)-1-(6,7-dimethoxyisoquinolin-4-yl)-2-oxidanylidene-ethyl]carbamic acid Openeye Name: [1-(6,7-dimethoxy-4-isoquinolyl)-2-oxo-2-(3-sec-butoxyphenyl)ethyl]carbamic acid CAS Name: [2-(3-butan-2-yloxyphenyl)-1-(6,7-dimethoxy-4-isoquinolinyl)-2-oxoethyl]carbamic acid IUPAC Name: [2-(3-butan-2-yloxyphenyl)-1-(6,7-dimethoxyisoquinolin-4-yl)-2-oxoethyl]carbamic acid Traditional Name: [1-(6,7-dimethoxy-4-isoquinolyl)-2-keto-2-(3-sec-butoxyphenyl)ethyl]carbamic acid Formula: C24H26N2O6 MolecularWeight: 438.47304

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC1=CC=CC(=C1)C(=O)C(C2=CN=CC3=CC(=C(C=C32)OC)OC)NC(=O)O

Isomeric SMILES

CCC(C)OC1=CC=CC(=C1)C(=O)C(C2=CN=CC3=CC(=C(C=C32)OC)OC)NC(=O)O

InChI

InChI=1S/C24H26N2O6/c1-5-14(2)32-17-8-6-7-15(9-17)23(27)22(26-24(28)29)19-13-25-12-16-10-20(30-3)21(31-4)11-18(16)19/h6-14,22,26H,5H2,1-4H3,(H,28,29)