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methyl (E)-3-[4-methoxy-2-[(nonanoylamino)methyl]-5-oxidanyl-phenyl]prop-2-enoate

methyl (E)-3-[4-methoxy-2-[(nonanoylamino)methyl]-5-oxidanyl-phenyl]prop-2-enoate

Systemtic Name:methyl (E)-3-[4-methoxy-2-[(nonanoylamino)methyl]-5-oxidanyl-phenyl]prop-2-enoate
Openeye Name:methyl (E)-3-[5-hydroxy-4-methoxy-2-[(nonanoylamino)methyl]phenyl]prop-2-enoate
CAS Name:(E)-3-[5-hydroxy-4-methoxy-2-[(1-oxononylamino)methyl]phenyl]-2-propenoic acid methyl ester
IUPAC Name:methyl (E)-3-[5-hydroxy-4-methoxy-2-[(nonanoylamino)methyl]phenyl]prop-2-enoate
Traditional Name:(E)-3-[5-hydroxy-4-methoxy-2-[(pelargonylamino)methyl]phenyl]acrylic acid methyl ester
Formula: C21H31NO5
MolecularWeight: 377.47454
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(=O)NCC1=CC(=C(C=C1C=CC(=O)OC)O)OC


Isomeric SMILES

CCCCCCCCC(=O)NCC1=CC(=C(C=C1/C=C/C(=O)OC)O)OC


InChI

InChI=1S/C21H31NO5/c1-4-5-6-7-8-9-10-20(24)22-15-17-14-19(26-2)18(23)13-16(17)11-12-21(25)27-3/h11-14,23H,4-10,15H2,1-3H3,(H,22,24)/b12-11+


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