ethyl 4-[2-[2-methoxy-4-[(prop-2-enylamino)methyl]phenoxy]ethanoylamino]benzoate

Systemtic Name: ethyl 4-[2-[2-methoxy-4-[(prop-2-enylamino)methyl]phenoxy]ethanoylamino]benzoate Openeye Name: ethyl 4-[[2-[4-[(allylamino)methyl]-2-methoxy-phenoxy]acetyl]amino]benzoate CAS Name: 4-[[2-[2-methoxy-4-[(prop-2-enylamino)methyl]phenoxy]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[2-methoxy-4-[(prop-2-enylamino)methyl]phenoxy]acetyl]amino]benzoate Traditional Name: 4-[[2-[4-[(allylamino)methyl]-2-methoxy-phenoxy]acetyl]amino]benzoic acid ethyl ester Formula: C22H26N2O5 MolecularWeight: 398.45224

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)COC2=C(C=C(C=C2)CNCC=C)OC

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)COC2=C(C=C(C=C2)CNCC=C)OC

InChI

InChI=1S/C22H26N2O5/c1-4-12-23-14-16-6-11-19(20(13-16)27-3)29-15-21(25)24-18-9-7-17(8-10-18)22(26)28-5-2/h4,6-11,13,23H,1,5,12,14-15H2,2-3H3,(H,24,25)