[1-[2-bromanylprop-2-enyl-[(2,4-dimethoxyphenyl)methyl]amino]-1-oxidanylidene-pent-4-en-2-yl]carbamic acid

Systemtic Name: [1-[2-bromanylprop-2-enyl-[(2,4-dimethoxyphenyl)methyl]amino]-1-oxidanylidene-pent-4-en-2-yl]carbamic acid Openeye Name: 1-[2-bromoallyl-[(2,4-dimethoxyphenyl)methyl]carbamoyl]but-3-enylcarbamic acid CAS Name: [1-[2-bromoprop-2-enyl-[(2,4-dimethoxyphenyl)methyl]amino]-1-oxopent-4-en-2-yl]carbamic acid IUPAC Name: [1-[2-bromoprop-2-enyl-[(2,4-dimethoxyphenyl)methyl]amino]-1-oxopent-4-en-2-yl]carbamic acid Traditional Name: 1-[2-bromoallyl-(2,4-dimethoxybenzyl)carbamoyl]but-3-enylcarbamic acid Formula: C18H23BrN2O5 MolecularWeight: 427.28962

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CN(CC(=C)Br)C(=O)C(CC=C)NC(=O)O)OC

Isomeric SMILES

COC1=CC(=C(C=C1)CN(CC(=C)Br)C(=O)C(CC=C)NC(=O)O)OC

InChI

InChI=1S/C18H23BrN2O5/c1-5-6-15(20-18(23)24)17(22)21(10-12(2)19)11-13-7-8-14(25-3)9-16(13)26-4/h5,7-9,15,20H,1-2,6,10-11H2,3-4H3,(H,23,24)