ethyl 3-[(5-acetamido-2-methoxy-cyclohexa-1,5-dien-1-yl)-(1-chloranylprop-2-enyl)amino]propanoate

Systemtic Name: ethyl 3-[(5-acetamido-2-methoxy-cyclohexa-1,5-dien-1-yl)-(1-chloranylprop-2-enyl)amino]propanoate Openeye Name: ethyl 3-[(5-acetamido-2-methoxy-cyclohexa-1,5-dien-1-yl)-(1-chloroallyl)amino]propanoate CAS Name: 3-[(5-acetamido-2-methoxy-1-cyclohexa-1,5-dienyl)-(1-chloroprop-2-enyl)amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[(5-acetamido-2-methoxycyclohexa-1,5-dien-1-yl)-(1-chloroprop-2-enyl)amino]propanoate Traditional Name: 3-[(5-acetamido-2-methoxy-cyclohexa-1,5-dien-1-yl)-(1-chloroallyl)amino]propionic acid ethyl ester Formula: C17H25ClN2O4 MolecularWeight: 356.8444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN(C1=C(CCC(=C1)NC(=O)C)OC)C(C=C)Cl

Isomeric SMILES

CCOC(=O)CCN(C1=C(CCC(=C1)NC(=O)C)OC)C(C=C)Cl

InChI

InChI=1S/C17H25ClN2O4/c1-5-16(18)20(10-9-17(22)24-6-2)14-11-13(19-12(3)21)7-8-15(14)23-4/h5,11,16H,1,6-10H2,2-4H3,(H,19,21)