N-cyclopropyl-3-[2-[(4-methoxyphenyl)methyl]-1-oxidanylidene-isoquinolin-6-yl]-4-methyl-benzamide

Systemtic Name: N-cyclopropyl-3-[2-[(4-methoxyphenyl)methyl]-1-oxidanylidene-isoquinolin-6-yl]-4-methyl-benzamide Openeye Name: N-cyclopropyl-3-[2-[(4-methoxyphenyl)methyl]-1-oxo-6-isoquinolyl]-4-methyl-benzamide CAS Name: N-cyclopropyl-3-[2-[(4-methoxyphenyl)methyl]-1-oxo-6-isoquinolinyl]-4-methylbenzamide IUPAC Name: N-cyclopropyl-3-[2-[(4-methoxyphenyl)methyl]-1-oxoisoquinolin-6-yl]-4-methylbenzamide Traditional Name: N-cyclopropyl-3-(1-keto-2-p-anisyl-6-isoquinolyl)-4-methyl-benzamide Formula: C28H26N2O3 MolecularWeight: 438.51764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2CC2)C3=CC4=C(C=C3)C(=O)N(C=C4)CC5=CC=C(C=C5)OC

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2CC2)C3=CC4=C(C=C3)C(=O)N(C=C4)CC5=CC=C(C=C5)OC

InChI

InChI=1S/C28H26N2O3/c1-18-3-6-22(27(31)29-23-8-9-23)16-26(18)20-7-12-25-21(15-20)13-14-30(28(25)32)17-19-4-10-24(33-2)11-5-19/h3-7,10-16,23H,8-9,17H2,1-2H3,(H,29,31)