(1-azanylisoquinolin-6-yl)methyl 2-[(1-aminocarbonylcyclohexyl)amino]ethanoate

Systemtic Name: (1-azanylisoquinolin-6-yl)methyl 2-[(1-aminocarbonylcyclohexyl)amino]ethanoate Openeye Name: (1-amino-6-isoquinolyl)methyl 2-[(1-carbamoylcyclohexyl)amino]acetate CAS Name: 2-[(1-carbamoylcyclohexyl)amino]acetic acid (1-amino-6-isoquinolinyl)methyl ester IUPAC Name: (1-aminoisoquinolin-6-yl)methyl 2-[(1-carbamoylcyclohexyl)amino]acetate Traditional Name: 2-[(1-carbamoylcyclohexyl)amino]acetic acid (1-amino-6-isoquinolyl)methyl ester Formula: C19H24N4O3 MolecularWeight: 356.41886

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C(=O)N)NCC(=O)OCC2=CC3=C(C=C2)C(=NC=C3)N

Isomeric SMILES

C1CCC(CC1)(C(=O)N)NCC(=O)OCC2=CC3=C(C=C2)C(=NC=C3)N

InChI

InChI=1S/C19H24N4O3/c20-17-15-5-4-13(10-14(15)6-9-22-17)12-26-16(24)11-23-19(18(21)25)7-2-1-3-8-19/h4-6,9-10,23H,1-3,7-8,11-12H2,(H2,20,22)(H2,21,25)