2-[3-chloranyl-2-(3-methoxycarbonylphenyl)-6-oxidanylidene-5-(propan-2-ylamino)pyrazin-1-yl]ethanoic acid

Systemtic Name: 2-[3-chloranyl-2-(3-methoxycarbonylphenyl)-6-oxidanylidene-5-(propan-2-ylamino)pyrazin-1-yl]ethanoic acid Openeye Name: 2-[3-chloro-5-(isopropylamino)-2-(3-methoxycarbonylphenyl)-6-oxo-pyrazin-1-yl]acetic acid CAS Name: 2-[3-chloro-2-(3-methoxycarbonylphenyl)-6-oxo-5-(propan-2-ylamino)-1-pyrazinyl]acetic acid IUPAC Name: 2-[3-chloro-2-(3-methoxycarbonylphenyl)-6-oxo-5-(propan-2-ylamino)pyrazin-1-yl]acetic acid Traditional Name: 2-[2-(3-carbomethoxyphenyl)-3-chloro-5-(isopropylamino)-6-keto-pyrazin-1-yl]acetic acid Formula: C17H18ClN3O5 MolecularWeight: 379.79492

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=NC(=C(N(C1=O)CC(=O)O)C2=CC(=CC=C2)C(=O)OC)Cl

Isomeric SMILES

CC(C)NC1=NC(=C(N(C1=O)CC(=O)O)C2=CC(=CC=C2)C(=O)OC)Cl

InChI

InChI=1S/C17H18ClN3O5/c1-9(2)19-15-16(24)21(8-12(22)23)13(14(18)20-15)10-5-4-6-11(7-10)17(25)26-3/h4-7,9H,8H2,1-3H3,(H,19,20)(H,22,23)