(E)-3-[2-carbamimidoyl-4-[(2-methylpropan-2-yl)oxycarbonyl]phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[2-carbamimidoyl-4-[(2-methylpropan-2-yl)oxycarbonyl]phenyl]prop-2-enoic acid Openeye Name: (E)-3-(4-tert-butoxycarbonyl-2-carbamimidoyl-phenyl)prop-2-enoic acid CAS Name: (E)-3-[2-carbamimidoyl-4-[(2-methylpropan-2-yl)oxy-oxomethyl]phenyl]-2-propenoic acid IUPAC Name: (E)-3-[2-carbamimidoyl-4-[(2-methylpropan-2-yl)oxycarbonyl]phenyl]prop-2-enoic acid Traditional Name: (E)-3-(2-amidino-4-tert-butoxycarbonyl-phenyl)acrylic acid Formula: C15H18N2O4 MolecularWeight: 290.31442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CC(=C(C=C1)C=CC(=O)O)C(=N)N

Isomeric SMILES

CC(C)(C)OC(=O)C1=CC(=C(C=C1)/C=C/C(=O)O)C(=N)N

InChI

InChI=1S/C15H18N2O4/c1-15(2,3)21-14(20)10-5-4-9(6-7-12(18)19)11(8-10)13(16)17/h4-8H,1-3H3,(H3,16,17)(H,18,19)/b7-6+