(E)-2-(3-azanyloxypropyl)-3-cyclohexyl-4-imidazol-1-yl-5-pyrazin-2-yl-pent-2-enoic acid

Systemtic Name: (E)-2-(3-azanyloxypropyl)-3-cyclohexyl-4-imidazol-1-yl-5-pyrazin-2-yl-pent-2-enoic acid Openeye Name: (E)-2-(3-aminooxypropyl)-3-cyclohexyl-4-imidazol-1-yl-5-pyrazin-2-yl-pent-2-enoic acid CAS Name: (E)-2-(3-aminooxypropyl)-3-cyclohexyl-4-(1-imidazolyl)-5-(2-pyrazinyl)-2-pentenoic acid IUPAC Name: (E)-2-(3-aminooxypropyl)-3-cyclohexyl-4-imidazol-1-yl-5-pyrazin-2-ylpent-2-enoic acid Traditional Name: (E)-2-(3-aminooxypropyl)-3-cyclohexyl-4-imidazol-1-yl-5-pyrazin-2-yl-pent-2-enoic acid Formula: C21H29N5O3 MolecularWeight: 399.48666

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=C(CCCON)C(=O)O)C(CC2=NC=CN=C2)N3C=CN=C3

Isomeric SMILES

C1CCC(CC1)/C(=C(/CCCON)\C(=O)O)/C(CC2=NC=CN=C2)N3C=CN=C3

InChI

InChI=1S/C21H29N5O3/c22-29-12-4-7-18(21(27)28)20(16-5-2-1-3-6-16)19(26-11-10-24-15-26)13-17-14-23-8-9-25-17/h8-11,14-16,19H,1-7,12-13,22H2,(H,27,28)/b20-18+