methyl 2-[[(E)-3-(4-bromophenyl)-2-methoxycarbonyl-prop-2-enyl]amino]-3-methyl-pentanoate

Systemtic Name: methyl 2-[[(E)-3-(4-bromophenyl)-2-methoxycarbonyl-prop-2-enyl]amino]-3-methyl-pentanoate Openeye Name: methyl 2-[[(E)-3-(4-bromophenyl)-2-methoxycarbonyl-allyl]amino]-3-methyl-pentanoate CAS Name: 2-[[(E)-3-(4-bromophenyl)-2-methoxycarbonylprop-2-enyl]amino]-3-methylpentanoic acid methyl ester IUPAC Name: methyl 2-[[(E)-3-(4-bromophenyl)-2-methoxycarbonylprop-2-enyl]amino]-3-methylpentanoate Traditional Name: 2-[[(E)-3-(4-bromophenyl)-2-carbomethoxy-allyl]amino]-3-methyl-valeric acid methyl ester Formula: C18H24BrNO4 MolecularWeight: 398.29146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC)NCC(=CC1=CC=C(C=C1)Br)C(=O)OC

Isomeric SMILES

CCC(C)C(C(=O)OC)NC/C(=C\C1=CC=C(C=C1)Br)/C(=O)OC

InChI

InChI=1S/C18H24BrNO4/c1-5-12(2)16(18(22)24-4)20-11-14(17(21)23-3)10-13-6-8-15(19)9-7-13/h6-10,12,16,20H,5,11H2,1-4H3/b14-10+