2-methoxyethyl (E)-3-[4-(azepan-1-yl)phenyl]-2-cyano-prop-2-enoate

Systemtic Name: 2-methoxyethyl (E)-3-[4-(azepan-1-yl)phenyl]-2-cyano-prop-2-enoate Openeye Name: 2-methoxyethyl (E)-3-[4-(azepan-1-yl)phenyl]-2-cyano-prop-2-enoate CAS Name: (E)-3-[4-(1-azepanyl)phenyl]-2-cyano-2-propenoic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl (E)-3-[4-(azepan-1-yl)phenyl]-2-cyanoprop-2-enoate Traditional Name: (E)-3-[4-(azepan-1-yl)phenyl]-2-cyano-acrylic acid 2-methoxyethyl ester Formula: C19H24N2O3 MolecularWeight: 328.40546

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC(=O)C(=CC1=CC=C(C=C1)N2CCCCCC2)C#N

Isomeric SMILES

COCCOC(=O)/C(=C/C1=CC=C(C=C1)N2CCCCCC2)/C#N

InChI

InChI=1S/C19H24N2O3/c1-23-12-13-24-19(22)17(15-20)14-16-6-8-18(9-7-16)21-10-4-2-3-5-11-21/h6-9,14H,2-5,10-13H2,1H3/b17-14+