N-[3-azanyl-4-(2-methoxyphenyl)-2-(3-methoxypropyl)-1-oxidanylidene-isoquinolin-7-yl]-4-methoxy-benzamide

Systemtic Name: N-[3-azanyl-4-(2-methoxyphenyl)-2-(3-methoxypropyl)-1-oxidanylidene-isoquinolin-7-yl]-4-methoxy-benzamide Openeye Name: N-[3-amino-4-(2-methoxyphenyl)-2-(3-methoxypropyl)-1-oxo-7-isoquinolyl]-4-methoxy-benzamide CAS Name: N-[3-amino-4-(2-methoxyphenyl)-2-(3-methoxypropyl)-1-oxo-7-isoquinolinyl]-4-methoxybenzamide IUPAC Name: N-[3-amino-4-(2-methoxyphenyl)-2-(3-methoxypropyl)-1-oxoisoquinolin-7-yl]-4-methoxybenzamide Traditional Name: N-[3-amino-1-keto-4-(2-methoxyphenyl)-2-(3-methoxypropyl)-7-isoquinolyl]-4-methoxy-benzamide Formula: C28H29N3O5 MolecularWeight: 487.54696

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=C(C2=C(C1=O)C=C(C=C2)NC(=O)C3=CC=C(C=C3)OC)C4=CC=CC=C4OC)N

Isomeric SMILES

COCCCN1C(=C(C2=C(C1=O)C=C(C=C2)NC(=O)C3=CC=C(C=C3)OC)C4=CC=CC=C4OC)N

InChI

InChI=1S/C28H29N3O5/c1-34-16-6-15-31-26(29)25(22-7-4-5-8-24(22)36-3)21-14-11-19(17-23(21)28(31)33)30-27(32)18-9-12-20(35-2)13-10-18/h4-5,7-14,17H,6,15-16,29H2,1-3H3,(H,30,32)