ethyl (E)-3-[1-azanyl-7-(2-azanylethoxy)isoquinolin-6-yl]prop-2-enoate

Systemtic Name: ethyl (E)-3-[1-azanyl-7-(2-azanylethoxy)isoquinolin-6-yl]prop-2-enoate Openeye Name: ethyl (E)-3-[1-amino-7-(2-aminoethoxy)-6-isoquinolyl]prop-2-enoate CAS Name: (E)-3-[1-amino-7-(2-aminoethoxy)-6-isoquinolinyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[1-amino-7-(2-aminoethoxy)isoquinolin-6-yl]prop-2-enoate Traditional Name: (E)-3-[1-amino-7-(2-aminoethoxy)-6-isoquinolyl]acrylic acid ethyl ester Formula: C16H19N3O3 MolecularWeight: 301.34036

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC1=C(C=C2C(=C1)C=CN=C2N)OCCN

Isomeric SMILES

CCOC(=O)/C=C/C1=C(C=C2C(=C1)C=CN=C2N)OCCN

InChI

InChI=1S/C16H19N3O3/c1-2-21-15(20)4-3-12-9-11-5-7-19-16(18)13(11)10-14(12)22-8-6-17/h3-5,7,9-10H,2,6,8,17H2,1H3,(H2,18,19)/b4-3+