2-[[(Z)-2-benzamido-3-[(3-methoxycarbonylpyrazin-2-yl)amino]prop-2-enoyl]amino]ethanoic acid

Systemtic Name: 2-[[(Z)-2-benzamido-3-[(3-methoxycarbonylpyrazin-2-yl)amino]prop-2-enoyl]amino]ethanoic acid Openeye Name: 2-[[(Z)-2-benzamido-3-[(3-methoxycarbonylpyrazin-2-yl)amino]prop-2-enoyl]amino]acetic acid CAS Name: 2-[[(Z)-2-benzamido-3-[(3-methoxycarbonyl-2-pyrazinyl)amino]-1-oxoprop-2-enyl]amino]acetic acid IUPAC Name: 2-[[(Z)-2-benzamido-3-[(3-methoxycarbonylpyrazin-2-yl)amino]prop-2-enoyl]amino]acetic acid Traditional Name: 2-[[(Z)-2-benzamido-3-[(3-carbomethoxypyrazin-2-yl)amino]acryloyl]amino]acetic acid Formula: C18H17N5O6 MolecularWeight: 399.35748

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NC=CN=C1NC=C(C(=O)NCC(=O)O)NC(=O)C2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=NC=CN=C1N/C=C(/C(=O)NCC(=O)O)\NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C18H17N5O6/c1-29-18(28)14-15(20-8-7-19-14)21-9-12(17(27)22-10-13(24)25)23-16(26)11-5-3-2-4-6-11/h2-9H,10H2,1H3,(H,20,21)(H,22,27)(H,23,26)(H,24,25)/b12-9-