ethyl (E)-3-(2-azanyl-6-methyl-5-pyridin-4-yl-pyridin-3-yl)prop-2-enoate

Systemtic Name: ethyl (E)-3-(2-azanyl-6-methyl-5-pyridin-4-yl-pyridin-3-yl)prop-2-enoate Openeye Name: ethyl (E)-3-[2-amino-6-methyl-5-(4-pyridyl)-3-pyridyl]prop-2-enoate CAS Name: (E)-3-(2-amino-6-methyl-5-pyridin-4-yl-3-pyridinyl)-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-(2-amino-6-methyl-5-pyridin-4-ylpyridin-3-yl)prop-2-enoate Traditional Name: (E)-3-[2-amino-6-methyl-5-(4-pyridyl)-3-pyridyl]acrylic acid ethyl ester Formula: C16H17N3O2 MolecularWeight: 283.32508

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC1=C(N=C(C(=C1)C2=CC=NC=C2)C)N

Isomeric SMILES

CCOC(=O)/C=C/C1=C(N=C(C(=C1)C2=CC=NC=C2)C)N

InChI

InChI=1S/C16H17N3O2/c1-3-21-15(20)5-4-13-10-14(11(2)19-16(13)17)12-6-8-18-9-7-12/h4-10H,3H2,1-2H3,(H2,17,19)/b5-4+