(Z)-3-[3-butoxy-4-[3-(heptylcarbamoylamino)phenyl]phenyl]-2-methoxy-prop-2-enoic acid

Systemtic Name: (Z)-3-[3-butoxy-4-[3-(heptylcarbamoylamino)phenyl]phenyl]-2-methoxy-prop-2-enoic acid Openeye Name: (Z)-3-[3-butoxy-4-[3-(heptylcarbamoylamino)phenyl]phenyl]-2-methoxy-prop-2-enoic acid CAS Name: (Z)-3-[3-butoxy-4-[3-[[(heptylamino)-oxomethyl]amino]phenyl]phenyl]-2-methoxy-2-propenoic acid IUPAC Name: (Z)-3-[3-butoxy-4-[3-(heptylcarbamoylamino)phenyl]phenyl]-2-methoxyprop-2-enoic acid Traditional Name: (Z)-3-[3-butoxy-4-[3-(heptylcarbamoylamino)phenyl]phenyl]-2-methoxy-acrylic acid Formula: C28H38N2O5 MolecularWeight: 482.61172

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNC(=O)NC1=CC=CC(=C1)C2=C(C=C(C=C2)C=C(C(=O)O)OC)OCCCC

Isomeric SMILES

CCCCCCCNC(=O)NC1=CC=CC(=C1)C2=C(C=C(C=C2)/C=C(/C(=O)O)\OC)OCCCC

InChI

InChI=1S/C28H38N2O5/c1-4-6-8-9-10-16-29-28(33)30-23-13-11-12-22(20-23)24-15-14-21(19-26(34-3)27(31)32)18-25(24)35-17-7-5-2/h11-15,18-20H,4-10,16-17H2,1-3H3,(H,31,32)(H2,29,30,33)/b26-19-