ethyl 2-[(4-methyl-6-nitro-3,4-dihydro-1H-isoquinolin-2-yl)methyl]prop-2-enoate

Systemtic Name: ethyl 2-[(4-methyl-6-nitro-3,4-dihydro-1H-isoquinolin-2-yl)methyl]prop-2-enoate Openeye Name: ethyl 2-[(4-methyl-6-nitro-3,4-dihydro-1H-isoquinolin-2-yl)methyl]prop-2-enoate CAS Name: 2-[(4-methyl-6-nitro-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl 2-[(4-methyl-6-nitro-3,4-dihydro-1H-isoquinolin-2-yl)methyl]prop-2-enoate Traditional Name: 2-[(4-methyl-6-nitro-3,4-dihydro-1H-isoquinolin-2-yl)methyl]acrylic acid ethyl ester Formula: C16H20N2O4 MolecularWeight: 304.341

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C)CN1CC(C2=C(C1)C=CC(=C2)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C(=C)CN1CC(C2=C(C1)C=CC(=C2)[N+](=O)[O-])C

InChI

InChI=1S/C16H20N2O4/c1-4-22-16(19)12(3)9-17-8-11(2)15-7-14(18(20)21)6-5-13(15)10-17/h5-7,11H,3-4,8-10H2,1-2H3