methyl N-[2-(2-azanyl-2-oxidanylidene-ethyl)-3,4-dihydro-1H-isoquinolin-7-yl]carbamate

Systemtic Name: methyl N-[2-(2-azanyl-2-oxidanylidene-ethyl)-3,4-dihydro-1H-isoquinolin-7-yl]carbamate Openeye Name: methyl N-[2-(2-amino-2-oxo-ethyl)-3,4-dihydro-1H-isoquinolin-7-yl]carbamate CAS Name: N-[2-(2-amino-2-oxoethyl)-3,4-dihydro-1H-isoquinolin-7-yl]carbamic acid methyl ester IUPAC Name: methyl N-[2-(2-amino-2-oxoethyl)-3,4-dihydro-1H-isoquinolin-7-yl]carbamate Traditional Name: N-[2-(2-amino-2-keto-ethyl)-3,4-dihydro-1H-isoquinolin-7-yl]carbamic acid methyl ester Formula: C13H17N3O3 MolecularWeight: 263.29238

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC1=CC2=C(CCN(C2)CC(=O)N)C=C1

Isomeric SMILES

COC(=O)NC1=CC2=C(CCN(C2)CC(=O)N)C=C1

InChI

InChI=1S/C13H17N3O3/c1-19-13(18)15-11-3-2-9-4-5-16(8-12(14)17)7-10(9)6-11/h2-3,6H,4-5,7-8H2,1H3,(H2,14,17)(H,15,18)