2-methylbutyl (E)-3-(4-decoxyphenyl)prop-2-enoate; phenylmethanimine

Systemtic Name: 2-methylbutyl (E)-3-(4-decoxyphenyl)prop-2-enoate; phenylmethanimine Openeye Name: 2-methylbutyl (E)-3-(4-decoxyphenyl)prop-2-enoate; phenylmethanimine CAS Name: (E)-3-(4-decoxyphenyl)-2-propenoic acid 2-methylbutyl ester; phenylmethanimine IUPAC Name: 2-methylbutyl (E)-3-(4-decoxyphenyl)prop-2-enoate; phenylmethanimine Traditional Name: benzalamine; (E)-3-(4-decoxyphenyl)acrylic acid 2-methylbutyl ester Formula: C31H45NO3 MolecularWeight: 479.6939

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=C(C=C1)C=CC(=O)OCC(C)CC.C1=CC=C(C=C1)C=N

Isomeric SMILES

CCCCCCCCCCOC1=CC=C(C=C1)/C=C/C(=O)OCC(C)CC.C1=CC=C(C=C1)C=N

InChI

InChI=1S/C24H38O3.C7H7N/c1-4-6-7-8-9-10-11-12-19-26-23-16-13-22(14-17-23)15-18-24(25)27-20-21(3)5-2;8-6-7-4-2-1-3-5-7/h13-18,21H,4-12,19-20H2,1-3H3;1-6,8H/b18-15+;