4-[[2-[(3-carbamimidoylphenyl)methyl]-1-oxidanylidene-3,4-dihydroisoquinolin-6-yl]oxy]piperidine-1-carboximidamide

Systemtic Name: 4-[[2-[(3-carbamimidoylphenyl)methyl]-1-oxidanylidene-3,4-dihydroisoquinolin-6-yl]oxy]piperidine-1-carboximidamide Openeye Name: 4-[[2-[(3-carbamimidoylphenyl)methyl]-1-oxo-3,4-dihydroisoquinolin-6-yl]oxy]piperidine-1-carboxamidine CAS Name: 4-[[2-[(3-carbamimidoylphenyl)methyl]-1-oxo-3,4-dihydroisoquinolin-6-yl]oxy]-1-piperidinecarboximidamide IUPAC Name: 4-[[2-[(3-carbamimidoylphenyl)methyl]-1-oxo-3,4-dihydroisoquinolin-6-yl]oxy]piperidine-1-carboximidamide Traditional Name: 4-[[2-(3-amidinobenzyl)-1-keto-3,4-dihydroisoquinolin-6-yl]oxy]piperidine-1-carboxamidine Formula: C23H28N6O2 MolecularWeight: 420.50742

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1OC2=CC3=C(C=C2)C(=O)N(CC3)CC4=CC=CC(=C4)C(=N)N)C(=N)N

Isomeric SMILES

C1CN(CCC1OC2=CC3=C(C=C2)C(=O)N(CC3)CC4=CC=CC(=C4)C(=N)N)C(=N)N

InChI

InChI=1S/C23H28N6O2/c24-21(25)17-3-1-2-15(12-17)14-29-9-6-16-13-19(4-5-20(16)22(29)30)31-18-7-10-28(11-8-18)23(26)27/h1-5,12-13,18H,6-11,14H2,(H3,24,25)(H3,26,27)